共查询到20条相似文献,搜索用时 281 毫秒
1.
K. V. Yusenko I. V. Korolkov S. A. Gromilov S. V. Korenev 《Journal of Structural Chemistry》2007,48(2):379-382
The crystal structure of [Os(NH3)5Cl][ReCl6] has been refined by X-ray powder analysis: a = 11.645(3) Å, b = 8.3788(2) Å, c = 15.277(4) Å, β = 91.029(6)°, V = 1490(1) Å3, d x = 3.163 g/cm3, space group P21/m, Z = 4. The thermolysis product of the salt in a hydrogen atmosphere is a solid substitution solution Os0.5Re0.5: a = 2.753(2) Å, c = 4.366(3) Å, space group P63/mmc; coherent scattering region (CSR) is ~230 Å. 相似文献
2.
Synthesis and crystal structure of EnH<Superscript>2</Superscript>[IrCl<Superscript>6</Superscript>]
I. A. Baidina S. V. Korenev E. V. Makotchenko S.A. Gromilov 《Journal of Structural Chemistry》2005,46(4):725-731
The preparation of EnH2[IrCl6] is described. Crystal data for C2H10Cl6IrN2 are: a = 6.8972(11) Å, b = 6.9435(16) Å, c = 7.3354(11) Å; α = 88.269(3)°, β = 65.495(2)°, γ = 60.305(2)°, V = 270.76(9) Å3, space group P1, Z = 1, dcalc = 2.864 g/cm3. Crystal chemical analysis of the general motif of the structure was performed by the translation sublattice identification technique. It has been found that complex anions [IrCl6]2? follow the nodes of a rather regular rhombohedral subcell with the parameters ac = 7.1 Å, αc = 64°. 相似文献
3.
S. A. Gromilov S. V. Korenev I. A. Baidina S. P. Khranenko 《Journal of Structural Chemistry》2005,46(4):719-724
The paper describes the preparation techniques for β-fac-[Rh(NO2)3(NH3)3]. The complex crystallizes as colorless prisms belonging to the monoclinic crystal system. Crystal data: a = 6.6338(2) Å, b = 11.0627(3) Å, c = 11.5314(3) Å; β = 96.608(1)°, V = 840.64(4) Å3, space group P21/n, Z = 4, dcalc = 2.308 g/cm3. The structure is molecular and contains neutral complex molecules having the fac configuration. Crystal chemical analysis of the complex in comparison to α-fac-[Rh(NO2)3(NH3)3] is performed. 相似文献
4.
G. Y. S. K. Swamy B. Sridhar K. Ravikumar K. S. Reddy V. V. N. Reddy 《Journal of Structural Chemistry》2008,49(4):775-779
Two benzodiazepine derivatives, C23H22N2O (I), 2-methyl-8-methoxy-2,4-diphenyl-2,3-dihydro-1H-1,5-benzodiazepine, and C22H17N3O2Br2 (II), 2-methyl-7-nitro-2,4-bis(4′-bromophenyl)-2,3-dihydro-1H-1,5-benzodiazepine, were studied by single crystal X-ray diffraction method. Compound (I) crystallizes in the monoclinic system, space group P21/c, a = 13.1703(17) Å, b = 11.1990(14) Å, c = 12.9093(16) Å, β = 107.831(2)°, V = 1812.6(3) Å3, Z = 4. Compound (II) crystallizes in the monoclinic system, space group P21/n, a = 11.7345(12) Å, b = 12.7477(13) Å, c = 13.5965(14) Å, β = 95.221(2)°, V = 2025.4(4) Å3, Z = 4. The molecules of (I) and (II) have T-shape form with the diazepine ring at the junction point. The seven membered central benzodiazepine ring in both structures adopt a twist-boat conformation. The crystal packing is stabilized by C-H…π (in I) and C-H…O (in II) interactions. 相似文献
5.
The structure of (±)-2-[(1S,3S)-3-acetyl-2,2-dimethylcyclobutyl]-N-(p-tolyl)acetamide has been determined by single crystal X-ray diffraction analysis. The crystal belongs to triclinic system, space group P-1, a = 8.8700(18) Å, b = 10.331(2) Å, c = 10.363(2) Å, α = 71.11(3)°, β = 65.06(3)°, γ = 72.18(3)°, V = 798.6(3) Å3, Z = 2, formula unit C17H23NO2. The title compound has a fragment of 2,2-dimethylcyclo-butane and its conformation represents semi-chair. The intermolecular hydrogen bonds N-H...O and C-H...O are revealed. 相似文献
6.
E. V. Makotchenko I. A. Baidina S. A. Gromilov 《Journal of Structural Chemistry》2007,48(6):1156-1159
The DienH3[PtCl6]Cl complex was synthesized, and its crystal structure was determined. Crystal data for C4H16Cl7N3Pt: a = 6.8831(3) Å, b = 23.2767(12) Å, c = 9.6058(4) Å, = 90.593(2)°, V = 1538.92(12) Å3, space group P2(1)/n, Z = 4, ρcalc = 2.371 g/cm3. 相似文献
7.
T. V. Rybalova Yu. V. Gatilov D. D. Nekrasov A. E. Rubtsov A. G. Tolstikov 《Journal of Structural Chemistry》2005,46(6):1126-1130
The structure of two stereoisomeric spiroadducts of allobetulone with 5-phenyl-2,3-dihydrofuran-2,3-dione was established by X-ray diffraction (XRD) analysis. The crystals of the 2R isomer are orthorhombic, P212121, a = 10.825(5) Å, b = 12.849(6) Å, c = 23.358(9) Å; V = 3249(2) Å3, Z = 4, d calc = 1.200 g/cm3; the crystals of the 2S isomer hemihydrate are triclinic, P1, a = 11.505(7) Å, b = 12.192(8) Å, c = 13.123(8) Å; α = 103.35(5)°, β = 100.80(5)°, γ = 90.98(5)°; V = 1756(2) Å3, Z = 2, d calc = 1.127 g/cm3. The molecular structure of the spiroadducts is discussed. 相似文献
8.
K. V. Yusenko S. A. Gromilov I. A. Baidina I. V. Korolkov S. V. Korenev 《Journal of Structural Chemistry》2005,46(1):109-115
A binary complex salt [Rh(NH3)5Cl][ReBr6] has been synthesized and investigated by X-ray diffraction analysis. Crystal data: a = 8.541(5) Å, b = 12.015(6) Å, c = 16.496(9) Å; α = 73.695(10)°, β = 89.746(9)°, γ = 89.676(9)°, V = 1624.7 Å3, space group \(P\overline 1 \), Z = 4, D x = 3.635 g/cm3, R = 0.12. It is shown that the product of thermolysis of the salt in the atmosphere of hydrogen and helium is a solid solution Rh0.5Re0.5 with hcp cell parameters a = 2.731(5) Å and c = 4.368(7) Å. 相似文献
9.
The crystal structure of bis(semicarbazido)copper(II) nitrate [Cu(NH2NHC(O)NH2)2](NO3)2 has been studied by X-ray diffraction. Monoclinic crystals, a = 6.835(2) Å, b = 7.733(2) Å, c = 10.320(3) Å, β = 105.701(3)°, V = 525.1(2) Å3, space group P21/c, Z = 2, d
msd = 2.136 g/cm3, μ(MoK
α) = 2.143 mm−1. The structure was solved with the program for automatic analysis of Patterson’s function and refined by full-matrix least
squares in an anisotropic approximation for all non-hydrogen atoms using 753 independent reflections; R
1 = 0.0203. The square environment of the Cu atom is formed from the amino nitrogen atoms of the hydrazine fragments and the
C=O oxygen atoms of the two semicarbazide bidentate molecules (Cu-N 1.928 Å, Cu-O 1.999 Å). The axial positions are occupied
by the O atoms of the NO
3
−
outer-spheric anions (Cu-O 2.505 Å). In the structure, the complex cations and the NO
3
−
anions are linked into a framework by N-H...O type hydrogen bonds.
Original Russian Text Copyright ? 2007 by G. V. Romanenko, Z. A. Savelieva, and S. V. Larionov
__________
Translated from Zhurnal Strukturnoi Khimii, Vol. 48, No. 2, pp. 370–373, March–April, 2007. 相似文献
10.
P. E. Plyusnin E. Yu. Semitut I. A. Baidina L. A. Sheludyakova S. V. Korenev 《Journal of Structural Chemistry》2009,50(3):479-484
The crystal structures of compounds from the series [M(NH3)5Cl](NO3)2, (M = Ir, Rh, Ru) were described. The compounds crystallized in the tetragonal crystal system, space group I4, Z = 2. Crystal data for [Ir(NH3)5Cl](NO3)2 (I): a = 7.6061(1) Å, b = 7.6061(1) Å, c = 10.4039(2) Å, V = 601.894(16) Å3, ρcalc = 2.410 g/cm3, R = 0.0087; [Rh(NH3)5Cl](NO3)2 (II): a = 7.5858(5) Å, b = 7.5858(5) Å, c = 10.41357(7) Å, V = 599.24(7) Å3, ρcalc = 1.926 g/cm3, R = 0.0255; [Ru(NH3)5Cl](NO3)2 (III): a = 7.5811(6) Å, b = 7.5811(6) Å, c = 10.5352(14) Å, V = 605.49(11) Å3, ρcalc = 1.896 g/cm3, R = 0.0266. The compounds were defined by IR spectroscopy and XRPA and thermal analyses. 相似文献
11.
I. A. Baidina V. D. Il’yashevich V. F. Malakhov A. V. Belyaev 《Journal of Structural Chemistry》2007,48(5):973-976
The complex Na3(NH4)2[Ir(SO3)2Cl4]·4H2O was examined with single crystal X-ray diffraction and IR spectroscopy. Crystal data: a = 7.3144(4) Å, b = 10.0698(5) Å, c = 12.3748(6) Å, β = 106.203(1)°, V = 875.26(8) Å3, space group P21/c, Z = 2, d calc = 2.547 g/cm3. In the complex anion two trans SO 3 2? groups are coordinated to iridium through the S atom. The splitting of O-H bending vibrations of crystallization water molecules and N-H ones of the ammonium cation is considered in the context of different types of interactions with the closest neighbors in the structure. 相似文献
12.
The structure of the hexanuclear copper(II) β-diketonate complex with gfa (hexafluoroacetylacetone) and dpm (dipivalylmethanate) ligands was studied by low-temperature (T = 100 K) X-ray diffraction. Crystal data for Cu6(gfa)4(dpm)4(OH)4 [C64H84Cu6F24O20]: a = 28.2364(7) Å, b = 12.8072(3) Å, c = 24.7199(7) Å, β= 115.900(1)°, V = 8041.5(4) Å3, space group C2/m, Z = 4, d calc 1.661 g/cm3. The coordination polyhedra of the copper atoms — squares and octahedra — are formed by the oxygen atoms of the gfa and dpm ligands and groups. In all cases, the Cu-O distances vary from 1.89 Å to 2.13 Å. The complexes follow the sites of the rhombohedral sublattice with the parameters a c ≈ 14.4 Å and a c ≈ 61.5°. 相似文献
13.
I. A. Baidina E. Yu. Filatov E. V. Makotchenko A. I. Smolentsev 《Journal of Structural Chemistry》2012,53(1):112-118
Complex salts of the composition [Co(NH3)6](ReO4)3·2H2O (I), [Co(en)3](ReO4)3 (II), [Co(NH3)5H2O](ReO4)3·2H2O (III), and [Co(NH3)5Cl](ReO4)2·0.5H2O (IV) are obtained. Their crystal structures are determined by single crystal XRD. Crystallographic characteristics: (I) a = 9.9797(3) Å, b = 12.6994(3) Å, c = 14.7415(4) Å, β = 102.870(1)°, C2/c space group; (II) a = 8.0615(3) Å, b = 8.4483(4) Å c = 8.8267(4) Å, α = 61.923(2)°, β = 89.552(2)°, γ = 72.295(2)°, P1 space group; (III) a = 8.0086(4) Å, b = 12.9839(6) Å, c = 17.5122(7) Å, β=91.858(1)°, P21/n space group; (IV) a = 14.9446(3) Å, b = 14.6562(4) Å, c = 12.2434(4) Å, Cmc21 space group. 相似文献
14.
Two new isostructural zinc(II) complexes, [ZnCl2(L)] (I) and [ZnBr2(L)] (II), derived from the Schiff base ligand (1-pyridin-2-ylethylidene)pyridin-2-ylmethylamine (L), have been prepared and characterized by physicochemical methods and single-crystal X-ray crystallography. The crystal of I is monoclinic: space group P21/c, a = 11.699(3) Å, b = 8.460(2) Å, c = 14.766(3) Å, β = 99.686(3)°, V = 1440.6(6) Å3, Z = 4. The crystal of II is monoclinic: space group P21/n, a = 8.166(2) Å, b = 15.153(3) Å, c = 11.966(2) Å, β = 96.964(2)°, V = 1469.7(5) Å3, Z = 4. The geometry of the pentacoordinated zinc atoms in both complexes is best described as a square pyramid. 相似文献
15.
Thermal decomposition of [Pt(NH3)4][ReHlg6] binary complex salts (Hlg = Cl, Br) in a hydrogen atmosphere has been studied. Polycrystal X-ray diffractometry indicated that two-phase metallic systems are the final products of thermolysis. Structure refinement was performed for [Pt(NH3)4][ReCl6] by the combined technique involving decomposition of the diffractogram into individual reflections, isolation of reflections most sensitive to the position of separate light atoms, and full-profile analysis. Crystal data for PtReN4Cl6H12: a = 11.616(1) Å, b = 10.998(1) Å, c = 10.377(1) Å, V = 1148.1 Å3, space group Cmca, Z = 4, d x = 3.831 g/cm3. The indices are Rp = 5.48%, Rwp = 10.01%, R(F2) = 12.62%. The coordination polyhedron of Re is an almost regular octahedron: Re-Cl 2.34–2.36 Å, ∠ Cl-Re-Cl 86.9–90.3°; the coordination polyhedron of Pt is a square: Pt-N 2.04 Å, ∠N-Pt-N 90.4°. 相似文献
16.
S. P. Khranenko I. A. Baidina S. A. Gromilov A. V. Belyaev 《Journal of Structural Chemistry》2005,46(6):1060-1065
Powder and single crystal X-ray diffraction studies have been performed for anhydrous nitrate complexes Rb2[Pd(NO3)4] (I) and Cs2[Pd(NO3)4] (II). Crystal data for I: a = 7.843(1) Å, b = 7.970(1) Å, c = 9.725(1) Å; β = 100.39(1)°, V = 597.9(1) Å 3, space group P21/c, Z = 2, d calc = 2.918 g/cm3; for II: a = 10.309(2) Å, b = 10.426(2) Å, c = 11.839(2) Å; β = 108.17(3)°, V = 1209.0(4) Å3, space group P21/c, Z = 4, d calc = 3.408 g/cm3. The structures are formed by isolated [Pd(NO3)4]2? complex anions and alkali metal cations. The plane-square environment of the Pd atom is formed from the oxygen atoms of the monodentate nitrate groups. The geometrical characteristics of the complex anions are analyzed. Compound II has a short contact Pd...Cs 3.252 Å. 相似文献
17.
T. G. Cherkasova I. Yu. Bagryanskaya N. V. Pervukhina N. V. Kurat’eva V. V. Medvedev E. S. Tatarinova E. V. Cherkasova 《Russian Journal of Inorganic Chemistry》2017,62(6):760-765
New double complexes [Co(DMSO)6][SiF6] ? 2H2O (I) and [Co(DMF)3(H2O)3][SiF6] ? DMF (II) have been synthesized and studied by IR spectroscopy and X-ray diffraction. Crystals of complex I belong to the tetragonal symmetry system, space group R3?, Z = 3, a = 11.8232(3) Å, c = 18.4699(5) Å, V = 2235.97(10) Å3, ρcalc = 1.573 g/cm3. Crystals of complex II are triclinic, space group P1?, Z = 2, a = 8.6264(4) Å, b = 10.1419(4) Å, c = 13.9657(6) Å, α = 100.847(2)°, β = 98.549(2)°, γ = 93.479(2)°, V = 1181.71(9) Å3, ρcalc = 1.539 g/cm3. 相似文献
18.
Triethylammonium dicitratoborate monohydrate (C2H5)3NH[(C6H6O7)2B]·H2O (I) was synthesized for the first time. Its crystal structure was solved from single crystal X-ray diffraction data (a = 9.7821(2) Å, b = 23.2196(4) Å, c = 10.0705(2) Å; β = 90.97(1)°; Z = 4, space group P21/n, 5091 reflections with R int = 0.0219; R1 = 0.0733). The structural units of crystal I (the large dicitrato borate anion with a spirane structure, the triethylammonium cation, and the crystal water molecule) form a layered packing with a system of seven O-H...O and N-H...O hydrogen bonds. 相似文献
19.
A. A. Bessonov I. A. Baidina N. B. Morozova N. V. Kuratieva N. V. Gelfond I. K. Igumenov 《Journal of Structural Chemistry》2008,49(1):64-68
A crystal-chemical study of dimethylgold(III) complexes with 8-hydroxyquinoline (CH3)2Au(OR) and 8-mercaptoquinoline (CH3)2Au(SR) (R = C9H6N) was performed. Crystal data for (CH3)2Au(OR): a = 8.7133(17) Å, b = 27.875(6) Å, c = 8.6688(17) Å, β = 102.76(3)°, Z = 8, ρ(calc) = 2.401 g/cm3, space group P21/c, R = 0.0909; for (CH3)2Au(SR): a = 3.5401(7) Å, b = 15.689(3) Å, c = 19.910(4) Å, β = 99.81(3)°, Z = 4, ρ(calc) = 2.361 g/cm3, space group P21/c, R = 0.0712. Both structures are molecular and involve neutral (CH3)2Au(L) molecules, L = C9H6NO or C9H6NS. In the structures, the molecules are arranged in stacks joined by van der Waals interactions. The average Au…Au intrastack distances are 3.57 Å and 4.34 Å for (CH3)2Au(OR) and 3.5 Å for (CH3)2Au(SR). 相似文献
20.
P. A. Stabnikov L. G. Bulusheva N. I. Alferova A. I. Smolentsev I. A. Korol’kov N. V. Pervukhina I. A. Baidina 《Journal of Structural Chemistry》2012,53(4):740-747
Crystal structures are determined (Bruker Nonius X8 Apex, 4K CCD-detector, λMoK α, graphite monochromator, T 150 K and 293 K) for two β-diketones F3CC(O)CH2C(O)Ph (1) (space group P21/c, a = 7.0713(3)Å, b = 11.5190(6)Å, c = 11.3602(6) Å, β = 99.405(2)°, V = 912.90(8) Å3, Z = 4), (CH3)3CC(O)CH2C(O)C(CH3)3 (2) (space group Pbca, a = 11.5536(8) Å, b = 11.5796(10) Å, c = 17.2523(13) Å, V = 2308.1(3) Å3, Z = 8) and a ketoimine (CH3)3CC(NCH3)CH2C(O)C(CH3)3 (3) (space group I41/a, a = 18.7687(6) Å, b = 18.7687(6) Å, c = 14.5182(6) Å, V = 5114.2(3) Å3, Z = 16). All structures are molecular and comprise isolated molecules joined by van der Walls interactions. The substitution energy of a Na atom for a hydrogen atom in free ligands is calculated by the hybrid B3LYP quantum chemical method. A successful preparation of Na(I) chelates with ligands 1, 2 and failed attempts to prepare a complex with ligand 3 are in accordance with the calculations. Geometrical simulation of a copper(II) complex with ligand 3 reveals the overlap of CH3 groups which hinders the complexation. 相似文献