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991.
Ruibiao Fu 《Journal of solid state chemistry》2004,177(12):4626-4631
A new silver organodiphosphonate, [Ag4(O3PCH2CH2PO3)] (1), has been synthesized and characterized by X-ray diffraction, IR, TGA-DSC, electricity measurement and element analysis. 1 crystallizes in the monoclinic space group P2(1)/n (a=6.0115(16) Å, b=8.630(2) Å, c=8.462(2) Å, β=97.693(4)°, Z=2, R1=0.0604, wR2=0.1450). 1 contains one-dimensional channels and a three-dimensional Ag?Ag interacted substructural net. TGA and XRD indicate little weight loss up to 300 °C and little structure change after heated at 170 °C for 2 h, respectively. The grain interior conductivity of 1 increases continuously from 50 to 170 °C. Results of EHT calculations show that under thermal or optical excitation the conductivity of 1 is mainly due to transfer of π antibonding electrons of -PO3 group through O atom to Ag 5s orbital, which also leads to enhancement of Ag?Ag interactions and promotes formation of Ag?Ag substructural net. 相似文献
992.
T. M. Polyanskaya 《Journal of Structural Chemistry》2006,47(5):887-893
A single crystal X-ray diffraction study of a new iodine-containing cluster compound 9-(pyridine)-11-iodo-decahydro-7,8-dicarba-nido-undecaborane [9-C5H5N-11-I-7,8-C2B9H10] has been performed. Crystal data: C7H15B9NI, M = 337.39, monoclinic, space group P21/c, unit cell parameters: a = 9.348(1) Å, b = 11.159(1) Å, c = 13.442(2) Å, β = 98.13(1)°, V = 1388.1(5) Å3, Z = 4, d calc = 1.614 g/cm3, T = 295 K, F(000) = 648, μ = 2.276 mm?1. The structure was solved by a direct method and refined in the full-matrix anisotropic approximation (isotropic for hydrogen atoms) to final agreement factors R 1 = 0.0254, wR 2 = 0.0454 for 2437 I hkl ≥ 2σI from 3590 measured I hkl (an Enraf-Nonius CAD-4 diffractometer, λMoK α , graphite monochromator, θ/2θ-scanning). The molecules are joined into a supramolecular assembly by hydrogen bonds X-H?I (X = B, C). 相似文献
993.
994.
YAO Tian-Ming YOU Xiao-ZengCoordination Chemistry Institute State Key Laboratory of Coordination Chemistry Nanjing University Nanjing ChinaYANG Qing-ChuanChemistry Department Beijing University Beijing China 《中国化学》1994,12(3):248-257
The reaction of CuCl2-2H2O or NiCl2.6H2O with K2(C5H6S4) [potassium salt of 6,7-dihydro-5H-1,4-dithiepin-2,3-dithiolate] under nitrogen atmosphere resulted in the isolation of [Cu(C5H6S4)2]- or [Ni(C5H6S4)2]- as the tetrabutylammonium salt. Both complexes show characteristic IR and UV-Vis absorptions of transition metal dithiolenes. Cyclic voltammograms contain two waves indicating a two step electrochemical procedure [M(C5H6S4)2]0 = [M(C5H6S4)2]1-= [M(C5H6S4)2]2-. Single crystal structure study has been carried out on the nickel complex. Crystal of [Bu4N][Ni(C5H6S4)2] belongs to monoclinic space group P21/c with a=17.576(5), 6=10.883(2), c=17.773(4) A,B=91.07(2)0, Z=4, and o(calcd.)=1.348 g/cm3. Final result is R=0.059 for 2959 reflections. The NiS4 core exhibits square planar coordination with average Ni-S bond length of 2.134(5) A. There are not anion pairs in crystal. The anions stack along a and c axes while the cations intercalate in them. The nearest S-S contact is 4.429 A. The solid powder ESR s 相似文献
995.
996.
Li2H4I2O10, the First Tetrahydrogendimesoperiodate Li2H4I2O10 has been obtained as an intermediate during the dehydration of LiH4IO6 · H2O to LiIO4, for the first time. According to the results of an X-ray structure determination (monoclinic, P21/n, a = 533.98(4), b = 471.85(4), c = 1431.48(10) pm, β = 91.614(7)°, Z = 2, 726 diffractometer data, R = 0.056), Li2H4I2O10 contains the previously unknown tetrahydrogendimesoperiodate ion H4I2O102?, consisting of two edge-shared IO6 octahedra. They are connected with LiO6 octahedra via common edges and vertices. The crystals are non-merohedrally twinned along (100). 相似文献
997.
MARIA BOCHENSKA VICTOR CH. KRAVTSOV VALERII E. ZAVODNIK 《Journal of inclusion phenomena and macrocyclic chemistry》1997,28(2):125-140
The structure of the lithium complex with1,3,5-tris[oxymethylene(N,N-dicyclohexyl)carboxyamido]cyclohexanehas been determined by the X-ray method.The compound is triclinic, space group P¯1,a = 15.623(3), b = 19.279(4),c = 19.295(4)Å = 102.32(3), = 92.45(3), = 105.67(3)0, V = 5436(2)Å3, Z = 4. Itscomposition is represented by the formulaC48H82N3O6LiI 0.5H2O. The lithium cationis encapsulated in a polar pseudo-cavity of six oxygen atoms of the ligandmolecule and displays a distorted trigonal prism coordination. The conformationof the ligand in the solid state complex has been compared with the conformationof the complex in solution determined by 1H-NMR measurements.Supplementary data relevant to this publication have been deposited with the British Library, No. SUP 82224 (21 pages). 相似文献
998.
999.
1000.
Synthesis, Crystal Structure, and Spectroscopic Characterization of Tetraphosphorus Hexaoxide Monoselenide, P4O6Se P4O6Se has been synthesized by photochemical reaction between P4O6 and elemental selenium in CS2 in presence of iodine as a catalyst. Single crystals form at purification via sublimation. The compound (m. p. 46°C) crystallizes in the monoclinic space group P21/c (no. 14) with a = 1 051.8(2), b = 652.9(1), c = 1 178.6(2) pm, β = 109.29(1)°, Z = 4. Within the limits of experimental error, the molecules exhibit C3v symmetry. IR, Raman, and 31P n.m.r. (solution) spectra of the compound are reported and discussed. The geometry of the Molecule as determined by theoretical methods (SCF level) is in good agreement with the experimental results. 相似文献