iii BIXOLON launches SRP-330III 3-inch thermal POS printer series By www.retailtechnologyreview.com Published On :: BIXOLON Europe GmbH, a subsidiary of BIXOLON the global manufacturer of advanced receipt, label and mobile printers, has launched its SRP-330III thermal point-of-sale printer series for all ticketing and receipting operations in the retail, hospitality and transportation sectors, an enhancement of the previous SRP-330II. Full Article Print and Label
iii The laser pump X-ray probe system at LISA P08 PETRA III By journals.iucr.org Published On :: 2024-06-06 Understanding and controlling the structure and function of liquid interfaces is a constant challenge in biology, nanoscience and nanotechnology, with applications ranging from molecular electronics to controlled drug release. X-ray reflectivity and grazing incidence diffraction provide invaluable probes for studying the atomic scale structure at liquid–air interfaces. The new time-resolved laser system at the LISA liquid diffractometer situated at beamline P08 at the PETRA III synchrotron radiation source in Hamburg provides a laser pump with X-ray probe. The femtosecond laser combined with the LISA diffractometer allows unique opportunities to investigate photo-induced structural changes at liquid interfaces on the pico- and nanosecond time scales with pump–probe techniques. A time resolution of 38 ps has been achieved and verified with Bi. First experiments include laser-induced effects on salt solutions and liquid mercury surfaces with static and varied time scales measurements showing the proof of concept for investigations at liquid surfaces. Full Article text
iii Bis[1,3-bis(2,4,6-trimethylphenyl)imidazolium] bis(μ-cis-1,2-diphenylethene-1,2-dithiolato-κ2S,S':κS)bis[(cis-1,2-diphenylethene-1,2-dithiolato-κ2S,S')iron(III)] dimethyl& By journals.iucr.org Published On :: 2023-12-26 The molecular structure of the solvated title salt, (C21H25N2)2[Fe2(C14H10S2)4]·2C3H7NO reveals that the anion is situated on a crystallographic inversion center in the triclinic space group Poverline{1}. The title compound crystallizes utilizing a network of weak π-stacking interactions of phenyl rings pertaining to the dithiolene unit. Moreover, the acidic imidazolium H atoms [N—C(H)—N] display non-classical hydrogen-bonding interactions of the C—H⋯O type to the oxygen atoms of the N,N-dimethyl formamide solvent, and hydrogen atoms on the backbone of imidazolium rings display weak C—H⋯S interactions with the dithiolene sulfur atoms. Full Article text
iii Chlorido[5,10,15,20-tetrakis(quinoline-7-carboxamido)porphinato]iron(III) By journals.iucr.org Published On :: 2024-06-04 The title compound, [Fe(C84H52N12O4)Cl], crystallizes in space group C2/c. The central FeIII cation (site symmetry 2) is coordinated in a fivefold manner, with four pyrrole N atoms of the porphyrin core in the basal sites and one Cl atom (site symmetry 2) in the apical position, which completes a slightly distorted square-pyramidal environment. The porphyrin macrocycle shows a characteristic ruffled-shape distortion and the iron atom is displaced out of the porphyrin plane by 0.42 Å with the average Fe—N distance being 2.054 (4) Å; the Fe—Cl bond length is 2.2042 (7) Å. Intermolecular C—H⋯N and C—H⋯O hydrogen bonds occur in the crystal structure. Full Article text
iii Dicarbonyl-1κ2C-μ-chlorido-2:3κ2Cl:Cl-pentachlorido-2κ2Cl,3κ3Cl-[1(η6)-toluene]digallium(III)ruthenium(I)(Ru—Ga) By journals.iucr.org Published On :: 2024-07-09 The title compound, [RuGa2Cl6(C7H8)(CO)2] or [(CO)2(GaCl2)(η6-toluene)Ru]+[GaCl4]−, was isolated from the reaction of Ga2Cl4 with diphenylsilanediol in toluene, followed by the addition of Ru3(CO)12. The compound contains a ruthenium–gallium metal–metal bond with a length of 2.4575 (2) Å. Full Article text
iii Bis[2-(isoquinolin-1-yl)phenyl-κ2N,C1](2-phenyl-1H-imidazo[4,5-f][1,10]phenanthroline-κ2N,N')iridium(III) hexafluoridophosphate methanol monosolvate By journals.iucr.org Published On :: 2024-09-06 The title compound, [Ir(C15H10N)2(C19H12N4)]PF6·CH3OH, crystallizes in the C2/c space group with one monocationic iridium complex, one hexafluoridophosphate anion, and one methanol solvent molecule of crystallization in the asymmetric unit, all in general positions. The anion and solvent are linked to the iridium complex cation via hydrogen bonding. All bond lengths and angles fall into expected ranges compared to similar compounds. Full Article text
iii Δ-Bis[(S)-2-(4-isopropyl-4,5-dihydrooxazol-2-yl)phenolato-κ2N,O1](1,10-phenanthroline-κ2N,N')ruthenium(III) hexafluoridophosphate By journals.iucr.org Published On :: 2024-09-17 The title compound, [Ru(C12H14NO2)2(C12H8N2)]PF6 crystallizes in the tetragonal Sohnke space group P41212. The two bidentate chiral salicyloxazoline ligands and the phenanthroline co-ligand coordinate to the central RuIII atom through N,O and N,N atom pairs to form bite angles of 89.76 (15) and 79.0 (2)°, respectively. The octahedral coordination of the bidentate ligands leads to a propeller-like shape, which induces metal-centered chirality onto the complex, with a right-handed (Δ) absolute configuration [the Flack parameter value is −0.003 (14)]. Both the complex cation and the disordered PF6− counter-anion are located on twofold rotation axes. Apart from Coulombic forces, the crystal cohesion is ensured by non-classical C—H⋯O and C—H⋯F interactions. Full Article text
iii Crystal structure and cryomagnetic study of a mononuclear erbium(III) oxamate inclusion complex By journals.iucr.org Published On :: 2024-07-10 The synthesis, crystal structure and magnetic properties of an oxamate-containing erbium(III) complex, namely, tetrabutylammonium aqua[N-(2,4,6-trimethylphenyl)oxamato]erbium(III)–dimethyl sulfoxide–water (1/3/1.5), (C16H36N)[Er(C11H12NO3)4(H2O)]·3C2H6OS·1.5H2O or n-Bu4N[Er(Htmpa)4(H2O)]·3DMSO·1.5H2O (1), are reported. The crystal structure of 1 reveals the occurrence of an erbium(III) ion, which is surrounded by four N-phenyl-substituted oxamate ligands and one water molecule in a nine-coordinated environment, together with one tetrabutylammonium cation acting as a counter-ion, and one water and three dimethyl sulfoxide (DMSO) molecules of crystallization. Variable-temperature static (dc) and dynamic (ac) magnetic measurements were carried out for this mononuclear complex, revealing that it behaves as a field-induced single-ion magnet (SIM) below 5.0 K. Full Article text
iii Mononuclear binding and catalytic activity of europium(III) and gadolinium(III) at the active site of the model metalloenzyme phosphotriesterase By journals.iucr.org Published On :: 2024-03-21 Lanthanide ions have ideal chemical properties for catalysis, such as hard Lewis acidity, fast ligand-exchange kinetics, high coordination-number preferences and low geometric requirements for coordination. As a result, many small-molecule lanthanide catalysts have been described in the literature. Yet, despite the ability of enzymes to catalyse highly stereoselective reactions under gentle conditions, very few lanthanoenzymes have been investigated. In this work, the mononuclear binding of europium(III) and gadolinium(III) to the active site of a mutant of the model enzyme phosphotriesterase are described using X-ray crystallography at 1.78 and 1.61 Å resolution, respectively. It is also shown that despite coordinating a single non-natural metal cation, the PTE-R18 mutant is still able to maintain esterase activity. Full Article text
iii The crystal structure of olanzapine form III By journals.iucr.org Published On :: 2024-07-29 The antipsychotic drug olanzapine is well known for its complex polymorphism. Although widely investigated, the crystal structure of one of its anhydrous polymorphs, form III, is still unknown. Its appearance, always in concomitance with forms II and I, and the impossibility of isolating it from that mixture, have prevented its structure determination so far. The scenario has changed with the emerging field of 3D electron diffraction (3D ED) and its great advantages in the characterization of polyphasic mixtures of nanosized crystals. In this study, we show how the application of 3D ED allows the ab initio structure determination and dynamical refinement of this elusive crystal structure that remained unknown for more than 20 years. Olanzapine form III is monoclinic and shows a similar but shifted packing with respect to form II. It is remarkably different from the lowest-energy structures predicted by the energy-minimization algorithms of crystal structure prediction. Full Article text
iii Crystal structures of ten phosphane chalcogenide complexes of gold(III) chloride and bromide By journals.iucr.org Published On :: 2024-03-12 The structures of ten phosphane chalcogenide complexes of gold(III) halides, with general formula R13–nR2nPEAuX3 (R1 = t-butyl; R2 = i-propyl; n = 0 to 3; E = S or Se; X = Cl or Br) are presented. The eight possible chlorido derivatives are: 9a, n = 3, E = S; 10a, n = 2, E = S; 11a, n = 1, E = S; 12a, n = 0, E = S; 13a, n = 3, E = Se; 14a, n = 2, E = Se; 15a, n = 1, E = Se; and 16a, n = 0, E = Se, and the corresponding bromido derivatives are 9b–16b in the same order. Structures were obtained for 9a, 10a (and a second polymorph 10aa), 11a (and its deuterochloroform monosolvate 11aa), 12a (as its dichloromethane monosolvate), 14a, 15a (as its deuterochloroform monosolvate 15aa, in which the solvent molecule is disordered over two positions), 9b, 11b, 13b and 15b. The structures of 11a, 15a, 11b and 15b form an isotypic set, and those of compounds 10aa and 14a form an isotypic pair. All structures have Z' = 1. The gold(III) centres show square-planar coordination geometry and the chalcogenide atoms show approximately tetrahedral angles (except for the very wide angle in 12a, probably associated with the bulky t-butyl groups). The bond lengths at the gold atoms are lengthened with respect to the known gold(I) derivatives, and demonstrate a considerable trans influence of S and Se donor atoms on a trans Au—Cl bond. Each compound with an isopropyl group shows a short intramolecular contact of the type C—Hmethine⋯Xcis; these may be regarded as intramolecular ‘weak’ hydrogen bonds, and they determine the orientation of the AuX3 groups. The molecular packing is analysed in terms of various short contacts such as weak hydrogen bonds C—H⋯X and contacts between the heavier atoms, such as X⋯X (9a, 10aa, 11aa, 15aa and 9b), S⋯S (10aa, 11a and 12a) and S⋯Cl (10a). The packing of the polymorphs 10a and 10aa is thus quite different. The solvent molecules take part in C—H⋯Cl hydrogen bonds; for 15aa, a disordered solvent region at z ≃ 0 is observed. Structure 13b involves unusual inversion-symmetric dimers with Se⋯Au and Se⋯Br contacts, further connected by Br⋯Br contacts. Full Article text
iii Crystal structure of tetraphenyl phosphate tetrakis[dimethyl (2,2,2-trichloroacetyl)phosphoramidato]lutetium(III), PPh4[LuL4] By journals.iucr.org Published On :: 2024-03-12 A lutetium(III) complex based on the anion of the ligand dimethyl (2,2,2-trichloroacetyl)phosphoramidate (HL) and tetraphenylphosphonium, of composition PPh4[LuL4] (L = CAPh = carbacylamidophosphate), or (C24H20)[Lu(C4H6Cl3NO4P)4], has been synthesized and structurally characterized. The X-ray diffraction study of the compound revealed that the lutetium ion is surrounded by four bis-chelating CAPh ligands, forming the complex anion [LuL4]− with a coordination number of 8[O] for LuIII, while PPh4+ serves as a counter-ion. The coordination geometry around the Lu3+ ion was determined to be a nearly perfect triangular dodecahedron. The complex crystallizes in the monoclinic crystal system, space group P21/c, with four molecules in the unit cell. Weak hydrogen bonds O⋯HC(Ph), Cl⋯HC(Ph) and N⋯HC(Ph) are formed between the cations and anions. For a comparative study, HL-based structures were retrieved from the Cambridge Structural Database (CSD) and their geometries and conformations are discussed. A Hirshfeld surface analysis was also performed. Full Article text
iii Crystal structures of fourteen halochalcogenylphosphonium tetrahalogenidoaurates(III) By journals.iucr.org Published On :: 2024-04-23 The structures of fourteen halochalcogenylphosphonium tetrahalogenidoaurates(III), phosphane chalcogenide derivatives with general formula [R13–nR2nPEX][AuX4] (R1 = t-butyl; R2 = isopropyl; n = 0 to 3; E = S or Se; X = Cl or Br) are presented. The eight possible chlorido derivatives are: 17a, n = 3, E = S; 18a, n = 2, E = S; 19a, n = 1, E = S; 20a, n = 0, E = S; 21a, n = 3, E = Se; 22a, n = 2, E = Se; 23a, n = 1, E = Se; and 24a, n = 0, E = Se, and the corresponding bromido derivatives are 17b–24b in the same order. Structures were obtained for all compounds except for the tri-t-butyl derivatives 24a and 24b. Isotypy is observed for 18a/18b/22a/22b, 19a/23a, 17b/21b and 19b/23b. In eleven of the compounds, X⋯X contacts (mostly very short) are observed between the cation and anion, whereby the E—X⋯X groups are approximately linear and the X⋯X—Au angles approximately 90°. The exceptions are 17a, 19a and 23a, which instead display short E⋯X contacts. Bond lengths in the cations correspond to single bonds P—E and E—X. For each group with constant E and X, the P—E—X bond-angle values increase monotonically with the steric bulk of the alkyl groups. The packing is analysed in terms of E⋯X, X⋯X (some between anions alone), H⋯X and H⋯Au contacts. Even for isotypic compounds, some significant differences can be discerned. Full Article text
iii Crystal structures of trichlorido(4-methylpiperidine)gold(III) and two polymorphs of tribromido(4-methylpiperidine)gold(III) By journals.iucr.org Published On :: 2024-04-18 Trichlorido(4-methylpiperidine)gold(III), [AuCl3(C6H13N)], 1, crystallizes in Pbca with Z = 8. Tribromido(4-methylpiperidine)gold(III), [AuBr3(C6H13N)], 2, crystallizes as two polymorphs, 2a in Pnma with Z = 4 (imposed mirror symmetry) and 2b, which is isotypic to 1. The Au—N bonds trans to Cl are somewhat shorter than those trans to Br, and the Au—Cl bonds trans to N are longer than those cis to N, whereas the Au—Br bonds trans to N are slightly shorter than the cis bonds. The methyl and AuX3 groups (X = halogen) occupy equatorial positions at the six-membered ring. The packing of all three structures involves chains of molecules with offset stacking of the AuX3 moieties associated with short Au⋯X contacts; for 1 and 2b these are reinforced by N—H⋯X hydrogen bonds, whereas for 2a there are no classical hydrogen bonds and the chains are interconnected by Br⋯Br contacts. Full Article text
iii Crystal structure of tris{N,N-diethyl-N'-[(4-nitrophenyl)(oxo)methyl]carbamimidothioato}cobalt(III) By journals.iucr.org Published On :: 2024-06-11 The synthesis, crystal structure, and a Hirshfeld surface analysis of tris{N,N-diethyl-N'-[(4-nitrophenyl)(oxo)methyl]carbamimidothioato}cobalt(III) conducted at 180 K are presented. The complex consists of three N,N-diethyl-N'-[(4-nitrobenzene)(oxo)methyl]carbamimidothioato ligands, threefold symmetrically bonded about the CoIII ion, in approximately octahedral coordination, which generates a triple of individually near planar metallacyclic (Co—S—C—N—C—O) rings. The overall geometry of the complex is determined by the mutual orientation of each metallacycle about the crystallographically imposed threefold axis [dihedral angles = 81.70 (2)°] and by the dihedral angles between the various planar groups within each asymmetric unit [metallacycle to benzene ring = 13.83 (7)°; benzene ring to nitro group = 17.494 (8)°]. The complexes stack in anti-parallel columns about the overline{3} axis of the space group (Poverline{3}), generating solvent-accessible channels along [001]. These channels contain ill-defined, multiply disordered, partial-occupancy solvent. Atom–atom contacts in the crystal packing predominantly (∼96%) involve hydrogen, the most abundant types being H⋯H (36.6%), H⋯O (31.0%), H⋯C (19.2%), H⋯N (4.8%), and H⋯S (4.4%). Full Article text
iii The crystal structure of a mononuclear PrIII complex with cucurbit[6]uril By journals.iucr.org Published On :: 2024-06-25 A new mononuclear complex, pentaaqua(cucurbit[6]uril-κ2O,O')(nitrato-κ2O,O')praseodymium(III) dinitrate 9.56-hydrate, [Pr(NO3)(CB6)(H2O)5](NO3)2·9.56H2O (1), was obtained as outcome of the hydrothermal reaction between the macrocyclic ligand cucurbit[6]uril (CB6, C36H36N24O12) with a tenfold excess of Pr(NO3)3·6H2O. Complex 1 crystallizes in the P21/n space group with two crystallographically independent but chemically identical [Pr(CB6)(NO3)(H2O)5]2+ complex cations, four nitrate counter-anions and 19.12 interstitial water molecules per asymmetric unit. The nonacoordinated PrIII in 1 are located in the PrO9 coordination environment formed by two carbonyl O atoms from bidentate cucurbit[6]uril units, two oxygen atoms from the bidentate nitrate anion and five water molecules. Considering the differences in Pr—O bond distances and O—Pr—O angles in the coordination spheres, the coordination polyhedrons of the two PrIII atoms can be described as distorted spherical capped square antiprismatic and muffin polyhedral. Full Article text
iii Crystal structures of seven gold(III) complexes of the form LAuX3 (L = substituted pyridine, X = Cl or Br) By journals.iucr.org Published On :: 2024-07-31 The structures of seven gold(III) halide derivatives of general formula LAuX3 (L = methylpyridines or dimethylpyridines, X = Cl or Br) are presented: trichlorido(2-methylpyridine)gold(III), [AuCl3(C6H7N)], 1 (as two polymorphs 1a and 1b); tribromido(2-methylpyridine)gold(III), [AuBr3(C6H7N)], 2; tribromido(3-methylpyridine)gold(III), [AuBr3(C6H7N)], 3; tribromido(2,4-dimethylpyridine)gold(III), [AuBr3(C7H9N)], 4; trichlorido(3,5-dimethylpyridine)gold(III), [AuCl3(C7H9N)], 5; tribromido(3,5-dimethylpyridine)gold(III), [AuBr3(C7H9N)], 6, and trichlorido(2,6-dimethylpyridine)gold(III), [AuCl3(C7H9N)], 7. Additionally, the structure of 8, the 1:1 adduct of 2 and 6, [AuBr3(C6H7N)]·[AuBr3(C7H9N)], is included. All the structures crystallize solvent-free, and all have Z' = 1 except for 5 and 7, which display crystallographic twofold rotation symmetry, and 4, which has Z' = 2. 1a and 2 are isotypic. The coordination geometry at the gold(III) atoms is, as expected, square-planar. Four of the crystals (1a, 1b, 2 and 8) were non-merohedral twins, and these structures were refined using the ‘HKLF 5’ method. The largest interplanar angles between the pyridine ring and the coordination plane are observed for those structures with a 2-methyl substituent of the pyridine ring. The Au—N bonds are consistently longer trans to Br (average 2.059 Å) than trans to Cl (average 2.036 Å). In the crystal packing, a frequent feature is the offset-stacked and approximately rectangular dimeric moiety (Au—X)2, with antiparallel Au—X bonds linked by Au⋯X contacts at the vacant positions axial to the coordination plane. The dimers are connected by further secondary interactions (Au⋯X or X⋯X contacts, `weak' C—H⋯X hydrogen bonds) to form chain, double chain (`ladder') or layer structures, and in several cases linked again in the third dimension. Only 1b and 7 contain no offset dimers; these structures instead involve C—H⋯Cl hydrogen bonds combined with Cl⋯Cl contacts (1b) or Cl⋯π contacts (7). The packing patterns of seven further complexes LAuX3 involving simple pyridines (taken from the Cambridge Structural Database) are compared with those of 1–8. Full Article text
iii Crystal structure of bis(μ2-5-nonanoylquinolin-8-olato)bis[aquadichloridoindium(III)] By journals.iucr.org Published On :: 2024-09-17 Crystallization of 5-nonanoyl-8-hydroxyquinoline in the presence of InCl3 in acetonitrile yields a dinuclear InIII complex crystallizing in the space group Poverline{1}. In this complex, [In2(C18H22NO2)2Cl4(H2O)2], each indium ion is sixfold coordinated by two chloride ions, one water molecule and two 8-quinolinolate ions. The crystal of the title complex is composed of two-dimensional supramolecular aggregates, resulting from the linkage of the Owater—H⋯O=C and Owater—H⋯Cl hydrogen bonds as well as bifurcated Carene—H⋯Cl contacts. Full Article text
iii Crystal structures of the (η2:η2-cycloocta-1,5-diene)(η6-toluene)iridium(I) cation and μ-chlorido-iridium(III) complexes of 2-(phosphinito)- and 2-(phosphinomethyl)anthraquinone ligands By journals.iucr.org Published On :: 2024-09-30 When reacted in dry, degassed toluene, [Ir(COD)Cl]2 (COD = cycloocta-1,5-diene) and 2 equivalents of 2-(di-tert-butylphosphinito)anthraquinone (tBuPOAQH) were found to form a unique tri-iridium compound consisting of one monoanionic dinuclear tri-μ-chlorido complex bearing one bidentate tBuPOAQ ligand per iridium, which was charge-balanced by an outer sphere [Ir(toluene)(COD)]+ ion, the structure of which has not previously been reported. This product, which is a toluene solvate, namely, (η2:η2-cycloocta-1,5-diene)(η6-toluene)iridium(I) tri-μ-chlorido-bis({3-[(di-tert-butylphosphanyl)oxy]-9,10-dioxoanthracen-2-yl}hydridoiridium(III)) toluene monosolvate, [Ir(C7H8)(C8H12)][Ir2H2(C22H24O3P)2Cl3]·C7H8 or [Ir(toluene)(COD)][Ir(κ-P,C-tBuPOAQ)(H)]2(μ-Cl)3]·toluene, formed as small orange platelets at room temperature, crystallizing in the triclinic space group Poverline{1}. The cation and anion are linked via weak C—H⋯O interactions. The stronger intermolecular attractions are likely the offset parallel π–π interactions, which occur between the toluene ligands of pairs of inverted cations and between pairs of inverted anthraquinone moieties, the latter of which are capped by toluene solvate molecules, making for π-stacks of four molecules each. The related ligand, 2-(di-tert-butylphosphinomethyl)-anthraquinone (tBuPCAQH), did not form crystals suitable for X-ray diffraction under analogous reaction conditions. However, when the reaction was conducted in chloroform, yellow needles readily formed following addition of 1 atm of carbon monoxide. Diffraction studies revealed a neutral, dinuclear, di-μ-chlorido complex, di-μ-chlorido-bis(carbonyl{3-[(di-tert-butylphosphanyl)oxy]-9,10-dioxoanthracen-2-yl}hydridoiridium(I)), [Ir2H2(C23H26O2P)2Cl2(CO)2] or [Ir(κ-P,C-tBuPCAQ)(H)(CO)(μ-Cl)]2, Ir2C48H54Cl2O6P2, again crystallizing in space group Poverline{1}. Offset parallel π–π interactions between anthraquinone groups of adjacent molecules link the molecules in one dimension. Full Article text
iii Crystal structures of seven mixed-valence gold compounds of the form [(R1R2R3PE)2AuI]+[AuIIIX4]− (R = tert-butyl or isopropyl, E = S or Se, and X = Cl or Br) By journals.iucr.org Published On :: 2024-09-30 During our studies of the oxidation of gold(I) complexes of trialkylphosphane chalcogenides, general formula R1R2R3PEAuX, (R = tert-butyl or isopropyl, E = S or Se, X = Cl or Br) with PhICl2 or elemental bromine, we have isolated a set of seven mixed-valence by-products, the bis(trialkylphosphane chalcogenido)gold(I) tetrahalogenidoaurates(III) [(R1R2R3PE)2Au]+[AuX4]−. These correspond to the addition of one halogen atom per gold atom of the AuI precursor. Compound 1, bis(triisopropylphosphane sulfide)gold(I) tetrachloridoaurate(III), [Au(C9H21PS)2][AuCl4] or [(iPr3PS)2Au][AuCl4], crystallizes in space group P21/n with Z = 4; the gold(I) atoms of the two cations lie on twofold rotation axes, and the gold(III) atoms of the two anions lie on inversion centres. Compound 2, bis(tert-butyldiisopropylphosphane sulfide)gold(I) tetrachloridoaurate(III), [Au(C10H23PS)2][AuCl4] or [(tBuiPr2PS)2Au][AuCl4], crystallizes in space group P1 with Z = 4; the asymmetric unit contains two cations and two anions with no imposed symmetry. A least-squares fit of the two cations gave an r.m.s. deviation of 0.19 Å. Compound 3, bis(tri-tert-butylphosphane sulfide)gold(I) tetrachloridoaurate(III), [Au(C12H27PS)2][AuCl4] or [(tBu3PS)2Au][AuCl4], crystallizes in space group P1 with Z = 1; both gold atoms lie on inversion centres. Compound 4a, bis(tert-butyldiisopropylphosphane sulfide)gold(I) tetrabromidoaurate(III), [Au(C10H23PS)2][AuBr4] or [(tBuiPr2PS)2Au][AuBr4], crystallizes in space group P21/c with Z = 4; the cation lies on a general position, whereas the gold(III) atoms of the two anions lie on inversion centres. Compound 4b, bis(tert-butyldiisopropylphosphane selenide)gold(I) tetrabromidoaurate(III), [Au(C10H23PSe)2][AuBr4] or [(tBuiPr2PSe)2Au][AuBr4], is isotypic with 4a. Compound 5a, bis(tri-tert-butylphosphane sulfide)gold(I) tetrabromidoaurate(III), [Au(C12H27PS)2][AuBr4] or [(tBu3PS)2Au][AuBr4], is isotypic with compound 4a. Compound 5a, bis(tri-tert-butylphosphane sulfide)gold(I) tetrabromidoaurate(III), [Au(C12H27PS)2][AuBr4] or [(tBu3PS)2Au][AuBr4], crystallizes in space group P1 with Z = 1; both gold atoms lie on inversion centres. Compound 5b, bis(tri-tert-butylphosphane selenide)gold(I) tetrabromidoaurate(III), [Au(C12H27PSe)2][AuBr4] or [(tBu3PSe)2Au][AuBr4], is isotypic with 5a. All AuI atoms are linearly coordinated and all AuIII atoms exhibit a square-planar coordination environment. The ligands at the AuI atoms are antiperiplanar to each other across the S⋯S vectors. There are several short intramolecular H⋯Au and H⋯E contacts. Average bond lengths (Å) are: P—S = 2.0322, P—Se = 2.1933, S—Au = 2.2915, and Se—Au = 2.4037. The complex three-dimensional packing of 1 involves two short C—Hmethine⋯Cl contacts (and some slightly longer contacts). For 2, four C—Hmethine⋯Cl interactions combine to produce zigzag chains of residues parallel to the c axis. Additionally, an S⋯Cl contact is observed that might qualify as a ‘chalcogen bond’. The packing of 3 is three-dimensional, but can be broken down into two layer structures, each involving an S⋯Cl and an H⋯Cl contact. For the bromido derivatives 4a/b and 5a/b, loose associations of the anions form part of the packing patterns. For all four compounds, these combine with an E⋯Br contact to form layers parallel to the ab plane. Full Article text
iii Automated pipeline processing X-ray diffraction data from dynamic compression experiments on the Extreme Conditions Beamline of PETRA III By journals.iucr.org Published On :: 2024-07-04 Presented and discussed here is the implementation of a software solution that provides prompt X-ray diffraction data analysis during fast dynamic compression experiments conducted within the dynamic diamond anvil cell technique. It includes efficient data collection, streaming of data and metadata to a high-performance cluster (HPC), fast azimuthal data integration on the cluster, and tools for controlling the data processing steps and visualizing the data using the DIOPTAS software package. This data processing pipeline is invaluable for a great number of studies. The potential of the pipeline is illustrated with two examples of data collected on ammonia–water mixtures and multiphase mineral assemblies under high pressure. The pipeline is designed to be generic in nature and could be readily adapted to provide rapid feedback for many other X-ray diffraction techniques, e.g. large-volume press studies, in situ stress/strain studies, phase transformation studies, chemical reactions studied with high-resolution diffraction etc. Full Article text
iii Coprecipitation of Ce(III) oxide with UO2 By journals.iucr.org Published On :: 2024-09-30 The neutralization of acidic solutions containing U (IV) and Ce (III) at room temperature in glove box atmosphere and in the presence of dithionite results in coprecipitation of these elements as amorphous solid solutions CexU1–xO2±y. The solubilities of the precipitates with different mole fractions (x) of Ce(OH)3 (x = 0.01 or 0.1) were determined in 1 M NaClO4 solutions between pH 2.2 and 12.8 under reducing conditions. The solids were investigated by a variety of methods (chemical analysis, SEM-EDX, XRD, XPS, XAS) to determine the nature of the solid solutions formed, their composition and the valence state of Ce and U. X-ray photoelectron spectroscopy confirmed the oxidation states of the solids both before and after the equilibration as Ce (III) and U (IV). The amorphous coprecipitates reached equilibrium relatively fast (∼1 week). The release of Ce from the coprecipitates was totally dominated by the release of uranium over the whole pH range. The Ce concentrations decrease slightly with the decrease of Ce content in the solid, suggesting that CexU1–xO2±y solids behave thermodynamically as solid solutions. The concentrations of U in equilibrium with the coprecipitate were in excellent agreement with the solubility of UO2(s) under reducing conditions reported in the literature. The conditional solubility product of Ce(OH)3 from the coprecipitate was several orders of magnitude (∼4 in the near neutral pH range and ∼18 in the acidic range) lower than that of pure Ce(OH)3(s). The activities and activity coefficients of Ce(OH)3(s) in the coprecipitate were also estimated. Activity coefficients are much less than 1, indicating that the mixing of Ce(OH)3 with UO2 is highly favorable. Full Article text
iii Foster Care Social Worker III By www.governmentjobs.com Published On :: Mon, 04 Nov 2024 23:52:49 GMT Catawba County Social Services is committed to making living better through serving children and families with multiple and complex needs. We are seeking individuals who share our common core values: Doing what’s right:Providing services to children and families when children must be separated from their parents or caretakers when they are unable or unwilling to provide adequate protection and care and the child enters the legal custody and placement responsibility of social services. Doing what matters most:Serving families, children, and our community by providing support and comprehensive family-centered, solution focused assessments and interventions that will support a parent’s capacity to protect and nurture their children. Doing it together:Working cohesively with birth and resource families, children, guardian ad litems, court partners, community and in-agency partners, and other child welfare entities to support and strengthen families. Doing it well:Striving for excellence in meeting all mandated standards in a fast-paced and mandated, but rewarding environment that ultimately seeks to assure child safety and develop and reinforce protective family units. Trainees, those with a Master’s or Bachelor’s degrees in other areas of human services, but do not have the required experience, may be considered. Trainee salary is $50,698.12. Full Article
iii PHCC’s Plumbing Contractor of the Year Awarded to Vincent “Trey” Giglio III of Louisiana By www.pmmag.com Published On :: Mon, 21 Oct 2024 00:00:00 -0400 Giglio is a dedicated member of PHCC of Louisiana’s leadership, currently serving as president-elect after more than a decade of work on the chapter’s Board of Directors Full Article
iii Marquis Who's Who Honors Alonzo D. Black III for Expertise in Entertainment By www.24-7pressrelease.com Published On :: Tue, 23 Apr 2024 08:00:00 GMT Alonzo D. Black III honored for his innovation at the intersection of music and technology Full Article
iii Aaron Alphonso Woodward III Presented with the Albert Nelson Marquis Lifetime Achievement Award by Marquis Who's Who By www.24-7pressrelease.com Published On :: Wed, 24 Jul 2024 08:00:00 GMT Aaron Alphonso Woodward III channels years of expertise to his work with Moxie Brokerage Group Full Article
iii Frank C. Druse III, PhD, Featured in the February 2024 Issue of GQ Magazine By www.24-7pressrelease.com Published On :: Tue, 14 May 2024 08:00:00 GMT Frank C. Druse III, PhD, shared his professional achievements and industry expertise in GQ magazine Full Article
iii Howard F. Nichols III, PE, has been Inducted into the Prestigious Marquis Who's Who Biographical Registry By www.24-7pressrelease.com Published On :: Fri, 09 Feb 2024 08:00:00 GMT Howard F. Nichols III is recognized for his expertise as a senior engineer with TRC Companies, Inc. Full Article
iii Marquis Who's Who Honors John H. Marino III for Expertise in the Dinnerware Sector By www.24-7pressrelease.com Published On :: Mon, 04 Nov 2024 08:00:00 GMT John H. Marino III excels in operations, sales manufacturing, design and technical aspects of porcelain China Full Article
iii Neurosurgeon Bennie W. Chiles III named a 2024 Castle Connolly Top Doctor By www.24-7pressrelease.com Published On :: Fri, 26 Jan 2024 08:00:00 GMT Bennie W. Chiles III, MD, has been named a 2024 Castle Connolly Top Doctor in the field of neurosurgery/spine surgery — the fifth consecutive year he has been recognized with the prestigious Top Doctor honor. Full Article
iii Jeff the Liquidator Announces Unprecedented Auction of Teenage Mutant Ninja Turtles III Memorabilia By www.24-7pressrelease.com Published On :: Wed, 06 Sep 2023 08:00:00 GMT Rare Opportunity to Own Amazing Cast Costumes, Props and more Full Article
iii Jess Sewell Bowen, III has been Inducted into the Prestigious Marquis Who's Who Biographical Registry By www.24-7pressrelease.com Published On :: Thu, 24 Aug 2023 08:00:00 GMT Jess Sewell Bowen, III is recognized for his expert leadership of the Luff-Bowen Funeral Home Full Article
iii Marquis Who's Who Honors Philip G. Ferraro III for Expertise in Financial Services By www.24-7pressrelease.com Published On :: Tue, 20 Aug 2024 08:00:00 GMT Philip G. Ferraro III is a financial expert dedicated to helping people overcome challenges and achieve their goals Full Article
iii Neurosurgeon Bennie W. Chiles III named a 2023 Castle Connolly Top Doctor By www.24-7pressrelease.com Published On :: Wed, 25 Jan 2023 08:00:00 GMT Bennie W. Chiles III, M.D., has been recognized as a 2023 Castle Connolly Top Doctor in the field of Neurosurgery/Spine Surgery —the fourth consecutive time he has received the prestigious Top Doctor honor. Full Article
iii George Shirley, III Celebrated for Dedication to the Field of Engineering By www.24-7pressrelease.com Published On :: Mon, 05 Feb 2024 08:00:00 GMT George Shirley lends years of expertise to his work with Tesla Full Article
iii Robert T. Slater III, MD, MPH, ABFM, ABOIM, Celebrated for Expertise in Health Care and Education By www.24-7pressrelease.com Published On :: Tue, 29 Oct 2024 08:00:00 GMT Robert T. Slater III, MD, MPH, ABFM, ABOIM, is an associate professor at the University of the Incarnate Word Full Article
iii Singer Songwriter Joe Little III Publishes 1st Children's Book 'Joey Wants to Sing' - Now Available By www.24-7pressrelease.com Published On :: Thu, 11 Jul 2024 08:00:00 GMT Childrens's Book ''Joey Wants to Sing" Published by Joe Little III (Lead Singer of the RnB 90"s Group Rude Boys) Full Article
iii Marquis Who's Who Honors George A. Kramer III, DVM, for Expertise in Veterinary Medicine and Higher Education By www.24-7pressrelease.com Published On :: Thu, 20 Jun 2024 08:00:00 GMT George A. Kramer III, DVM, is honored as the chief of staff at Atlantic Coast New York Veterinary Specialists Full Article
iii Jeff the Liquidator Announces Unprecedented Auction of Teenage Mutant Ninja Turtles III Memorabilia By www.24-7pressrelease.com Published On :: Fri, 25 Aug 2023 08:00:00 GMT Rare Opportunity to Own Amazing Cast Costumes, Props and more Full Article
iii William S. Ballenger III Recognized for Dedication to the Field of Journalism By www.24-7pressrelease.com Published On :: Thu, 01 Aug 2024 08:00:00 GMT William S. Ballenger III serves as the owner and publisher of The Ballenger Report Full Article
iii The Consulting Detective Trilogy Part III: Montague Street Concludes Biographical Series of the Young Sherlock Holmes with Thrilling Adventures and Untold Tales By www.24-7pressrelease.com Published On :: Mon, 11 Nov 2024 08:00:00 GMT Publisher Foolscap & Quill has released the final book in the four book series about the development of the young Sherlock Holmes into the famous consulting detective. Full Article
iii Harold Singleton III Celebrated for Dedication to the Financial Services Industry By www.24-7pressrelease.com Published On :: Tue, 08 Oct 2024 08:00:00 GMT Harold Singleton III channels years of expertise into board service with Hershey Trust Company and Fidelity Rutland Square Trust II at Fidelity Investments Full Article
iii Pop-Rock Band WORLD5 To Release Third Studio Album III on Spectra Music Group Label By www.24-7pressrelease.com Published On :: Thu, 25 Apr 2024 08:00:00 GMT WORLD5, the internationally pop-rock band, is set to release their highly anticipated third studio album, "III", on May 10, 2024. The album will be released under the Spectra Music Group label and is expected to receive critical acclaim. Full Article
iii // Indonesia 2008 ~ Faces and Views III By rwez.blogspot.com Published On :: Mon, 27 Oct 2008 22:06:00 +0000 iso: 320 aperture: f/4.0 exposure: 0.0025 s (1/400) focal: 60.0mmThe Intense Look of a Boy, Lembeh Paradise Resort, Sulawesi Utara, Indonesia.iso: 100 aperture: f/11.0 exposure: 0.050 s (1/20) focal: 60.0mmBunaken Sunset, Sulawesi Utara, Indonesia.iso: 400 aperture: f/5.6 exposure: 0.0063 s (1/160) focal: 70.0mmBoat in Sunset, Sulawesi Selatan, Indonesia.iso: 320 aperture: f/4.0 exposure: 0.025 s (1/40) focal: 42.0mmAn old friend, kampung Bila, Sulawesi Selatan, Indonesia.iso: 100 aperture: f/2.8 exposure: 0.250 s (1/4) focal: 12.0mmBantimurung, Sulawesi Selatan, Indonesia.iso: 100 aperture: f/8.0 exposure: 0.067 s (1/15) focal: 12.0mmChildren of Kampung Jakarta, Indonesia--© copyright Rick Wezenaar Photography. Full Article bantimurung bila boy buginese bugis bunaken indonesia jakarta landscape landscapes lembeh local boys photography sulawesi sulawesi selatan sulawesi utara
iii Sony A9 III: Game-changing Full-Frame Global Shutter, 120FPS 24.6MPx Camera By www.beyondphototips.com Published On :: Tue, 07 Nov 2023 21:19:19 +0000 This post: Sony A9 III: Game-changing Full-Frame Global Shutter, 120FPS 24.6MPx Camera was first published on Beyond Photo Tips by Susheel Chandradhas Sony announced the Sony A9 iii on 07 November 2023, a 24.6 Megapixel Full-frame mirrorless camera with the world’s first global shutter full-frame stacked CMOS image sensor capable of shooting at 120 frames per second. The camera also boasts a processor, the BIONZ XR, that is 8 times faster than the previous Sony BIONZ X […] This post: Sony A9 III: Game-changing Full-Frame Global Shutter, 120FPS 24.6MPx Camera was first published on Beyond Photo Tips Full Article Cameras A9iii Alpha camera Global Shutter Mirrorless Mirrorless Camera Sony
iii Eighth Circuit Holds Article III Standing Was Lacking for an Alleged Violation of the FCRA’s “Pre-Adverse Action” Notice Provision By www.littler.com Published On :: Wed, 06 Apr 2022 14:06:46 +0000 On April 4, 2022, the U.S. Court of Appeals for the Eighth Circuit joined the Ninth Circuit in holding that a plaintiff lacked Article III standing to prosecute her statutory claims under the Fair Credit Reporting Act (FCRA) in federal court. The Eighth Circuit’s opinion in Schumacher v. SC Data Center, Inc. deepens the split between the circuit courts on standing and increases the chances that the U.S. Supreme Court eventually will have to weigh in on the issue again. Background: Spokeo and Ramirez Full Article
iii Blessings III Canvas Giclee By www.thecollectionshop.com Published On :: 9/29/2010 Blessings III Canvas Giclee by John Holyfield is a(n) Limited Edition. The Edition is Limited to Limited Edition of 100 pcs Full Article
iii US Launched Minuteman III ICBM With Three Test Warheads By www.defensedaily.com Published On :: Thu, 07 Nov 2024 17:26:59 +0000 The U.S. Space Force tested the intercontinental ballistic missile’s ability to strike targets with multiple warheads in a Minuteman III launch Tuesday at Vandenberg Space Force Base, Calif. According to […] Full Article Nuclear Modernization
iii Blended Learning and Career and Technology Education - Part III: Implications for Career and Technical Education By careertechtesting.blogspot.com Published On :: Mon, 02 May 2016 19:44:00 +0000 In this four-part series, I’ll define blended learning, discuss the models of blended learning, the implications for career and technical education, and how the Curriculum, Assessment, and Digital Delivery (CADD) areas of the Oklahoma Department of Career and Technology Education can assist in the implementation of blended learning. Here are several ways that blended learning can have a profound effect upon career and technology education: Personalized instruction – Blended learning allows for a more personalized and interactive learning experience by putting the student in charge of their own learning. Taking the best of traditional education and blending it with the power of online learning will provide the teacher an opportunity to review data, in the moment, determine where the student is at and to form instruction for the next period or the next day. Increased monitoring – The use of a student information, assessment, and gradebook systems that link to the LMS provides instant feedback on assignments and assessments. This allows the instructor to spend time reviewing student data, adjust instruction, and provide additional classroom or individual instruction. Open entry/Open exit – Blended learning fits nicely with competency-based learning and the concept of open entry/open exit. Personalized instruction and increased monitoring will allow the instructor to more accurately determine when tasks and competencies are achieved. Increased enrollments – Depending on the blended learning model and the CTE program being offered, enrollments could potentially be increased. Increased performance gains – “The Rise of K–12 Blended Learning - Profiles of emerging models” by Heather Staker profiles 40 educational entities. Not every school reported gains and some thought it was too early to verify results, but many posted positive gains when compared to the traditional classrooms within the same district. For example: “School of One - Students in summer 2009 acquired new math skills at a rate estimated to be seven times faster than peers. Students in spring 2010 showed gains that, when annualized, would equate to 1/2 to 2/3 of an additional year of gain. Students in spring 2010 showed significant gains across all academic quartiles.” Other potential benefits from this study include increased retention rates, an increase in teacher/parent contacts, increased course completion rates, a strengthening of curriculum offerings, and lower instructional costs. As you can see, blended learning can have the potential to benefit the student, the instructor, and the parents in a careertech setting. Again, I’m not aware of any research that helps decide if one model works better with any certain occupational area (if you know of any research in this area, PLEASE SHARE!!). Full Article Blended Learning CareerTechEd CTE CTE Education Education Instruction Online Learning Technology
iii Traffic Safety News – Super Bowl XLVIII By news.delaware.gov Published On :: Wed, 29 Jan 2014 20:00:59 +0000 Super Bowl Sunday is only a few days away! Have you decided where you are going to watch Denver and Seattle go head to head? If your game plan includes cheering on your favorite team at a friend’s house or at a local sports bar, be sure to include a sober driver as the final play. Full Article Traffic Safety News checkpoint strikeforce dui highway safety publicsafety traffic enforcement traffic safety