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1.
The single crystals of [UO2SO4{(CH3)HNCONH(CH3)}2] (I) were synthesized and studied by X-ray diffraction. The crystals are monoclinic, a = 6.847(1) Å, b = 14.259(3) Å, c = 14.297(3) Å, β = 93.451(4)°, space group P21/n, Z = 4. The main structural units of crystals I are ribbons whose composition coincides with the composition of the compound. The crystal chemical formula of the complex is AT3M 2 1 (A = UO 2 2+ ).  相似文献   

2.
The single crystals of [UO2(C2O4){CONH2N(CH3)2}2] were synthesized and studied by X-ray diffraction. The crystals are monoclinic, a = 7.461(2) Å, b = 8.828(2) Å, c = 11.756(2) Å, β = 107.21(3)°, space group Pc, Z = 2, R = 2.94%. The structure comprises infinite chains [UO2(C2O4){CONH2N(CH3)2}2] extended along [001] and corresponding to the AT11M 2 1 crystallochemical group (A = UO 2 2+ , T11 = C2O 4 2? , M1 = N,N-CONH2N(CH3)2) of uranyl complexes. The chains are connected into a three-dimensional framework by hydrogen bonds involving the oxygen atoms of oxalate and uranyl ions and the N,N-dimethylcarbamide methyl groups.  相似文献   

3.
Single crystals of (NH4)(CN3H6)[UO2(SeO3)2] (I) are synthesized and studied by X-ray diffraction analysis. The compound crystallizes in the triclinic crystal system with the unit cell parameters: a = 7.0051(2) Å, b = 9.4234(3) Å, c = 9.5408(3) Å, α = 88.727(1)°, β = 70.565(1)°, γ= 77.034(1)°, space group P 1, Z = 2, R = 0.0224. The main structural units of crystals I are the [UO2(SeO3)2]2? chains of the crystal-chemical group AB2B11 (A = UO 2 2+ , B2= SeO3 2?, B11= SeO3 2?) of the uranyl complexes. The uranium-containing complexes are joined into a three-dimensional framework by the ammonium and guanidinium ions and a system of hydrogen bonds.  相似文献   

4.
The complex [UO2(SeO4)(C5H12N2O)2(H2O)] (I) was synthesized and studied by thermal analysis, IR spectroscopy, and X-ray crystallography. The crystals are orthorhombic: a = 13.1661(3) Å, b = 16.4420(5) Å, c = 17.4548(6) Å, Pbca, Z = 8, R = 0.0423. The structural units of crystal I are chains with the composition coinciding with that of the compounds of the AB2M 3 1 crystal chemical group of the uranyl complexes (A = UO 2 2+ , B2 = SeO 4 2? , M1 = C5H12N2O and H2O).  相似文献   

5.
Ammonium trinitratouranylate NH4[UO2(NO3)3] (I) single crystals have been synthesized by the reaction of aqueous solutions of diaquadinitratouranyl tetrahydrate and ammonium nitrate in the presence of nitric acid. The structure of the complex has been studied by X-ray diffraction analysis: space group \(R\bar 3c\), a = 9.361(2), c = 18.883(4) Å; V = 1433.0(5) Å3, and Z = 6. The structural units of the NH4[UO2(NO3)3] crystal—NH 4 + cations and [UO2(NO3)3]? complex anions with three bidentate cyclic nitrato groups—are on crystallographic axes \(\bar 3\). A complex three-dimensional packing arranged by the electrostatic attraction forces between counterions and the N-H...O hydrogen bonds between ammonium cations and trinitratouranylate anions is realized in the structure. X-ray diffraction analysis results are confirmed by IR spectra of NH4[UO2(NO3)3].  相似文献   

6.
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   

7.
The U(VI) complex with cyanoacetic acid, [UO2(H2O)2(NCCH2COO)2] (I), was synthesized from an aqueous solution, and its X-ray diffraction analysis was carried out. The crystals are orthorhombic: space group Pca2 1, a = 25.9605(7) Å, b = 6.7634(2) Å, c = 6.3398(2) Å, V = 1113.15(6) Å3 at 100 K, and Z = 4. The coordination polyhedron of the uranium atom is a distorted pentagonal bipyramid. The cations UO 2 2+ are bound into infinite zigzag chains by the bridging carboxyl groups of one of the anions of cyanoacetic acid. The carboxyl oxygen atom of the second anion, which is not involved in coordination, and the nitrogen atoms of the cyano groups form hydrogen bonds with the coordination water molecules. The layer structure of the compound is formed through the hydrogen bonds. The absorption spectra in the visible and infrared ranges of the crystalline compound are measured and analyzed.  相似文献   

8.
The crystal structure of [Cu(En)2CrO4]n (En is ethylenediamine) is determined: a = 14.7359(4) Å, b = 9.8083(3) Å, c = 14.2664(4) Å, V = 2061.98(10) Å3, space group Cmce, Z = 8, dx = 1.931 g/cm3. It is demonstrated that the studied phase is isostructural with [Сu(Еn)2SO4]n. A pseudotetragonal copper atom coordination (Cu–N 2.0204 Å and 2.0244 Å, ∠N–Cu–N 84.73°) is completed to distorted octahedral by two oxygen atoms of chromate anions (Cu–O 2.433 Å and 2.380 Å).  相似文献   

9.
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   

10.
The present research work reports the study on crystal structure, vibrational spectroscopy and thermal analysis of organic-inorganic hybrid compound (C6H5(CH2)2NH3)2CdCl4. Single crystals of bis(phenethylammonium)tetrachlorocadmate (C6H5(CH2)2NH3)2CdCl4 (PEA–Cd) were obtained by diffusion at room temperature. This compound crystallizes in the orthorhombic space group C2cb with unit cell parameters a = 7.4444(2) Å, b = 38.8965(3) Å, c = 7.3737(2) Å and Z = 4. Single crystal structure has been solved and refined to R = 0.036 and wR = 0.092. The structure consists of an extended [CdCl4]2– network and two [C6H5(CH2)2NH3]+ cations to form a two-dimensional perovskite system. The infrared (IR) spectrum of the title compound was recorded at room temperature. Differential scanning calorimetry (DSC) was used to investigate the phase transition; this compound exhibits a reversible single solid-solid phase transition.  相似文献   

11.
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   

12.
Novel complex salts [Au(en)2]Cl(ReO4)2 (I) and [Au(en)2](ReO4)3 (II), en = ethylenediamine, are obtained. Their crystal structures are determined by single crystal X-ray diffraction. Complex I crystallizes in the triclinic crystal system: a = 6.2172(7) Å, b = 7.1644(8) Å, c = 8.8829(8) Å, α = 96.605(4)°, β = 110.000(4)°, γ = 97.802(4)°, P-1 space group, Z = 1, d x = 3.905 g/cm3; complex II crystallizes in the monoclinic crystal system: a = 15.244(2) Å, b = 7.6809(8) Å, c = 9.3476(12) Å, β = 127.004(3)°, C2 space group, Z = 4, d x = 4.057 g/cm3.  相似文献   

13.
The [Ag(Bpp)](CF3CO2) complex (Bpp is 1,3-bis(4-pyridyl)propane, C13H14N2) is synthesized, and its structure is determined. The crystals are monoclinic, space group C2/c, a = 26.169(5), b = 10.521(2), c = 12.906(3) Å, β = 117.99(3)°, V = 3137.7(11) Å3, ρcalcd = 1.775 g/cm3, Z = 8. The structure contains double helices of-Ag-Bpp-Ag-Bpp-cationic chains with a helix period of 21.042 Å. The Ag…Ag distance between a pair of silver atoms from different chains in the helix is 3.201 Å, and the distance between the adjacent helices is 3.279 Å. The silver atom is linked with two bridging nitrogen atoms of two Bpp ligands in an almost linear coordination: Ag-Navg 2.142 Å; NagN, 171.3(4)°. The CF3C 2 ? anion has a weak contact with the silver ion (Ag…O 2.62(2) Å).  相似文献   

14.
The coordination polymers [AgPF6(Me4Pyz)2] (I) and [AgPF6(2,3-Et2Pyz)2] (II) were synthesized, and their structures were determined. Crystals of I are monoclinic, space group C2/c, a = 10.213(2) Å, b = 16.267(3) Å, c = 12.663(3) Å, β = 92.90(3)°, V = 2102.1(7) Å3, ρcalcd = 1.660 g/cm3, Z = 4. The structure of I is built of polymeric zigzag [Ag(C8H12N2)] + chains and octahedral [PF6] anions. The coordination polyhedron of the Ag+ ion is a flat triangle. Crystals of II are tetragonal, space group P \(\bar 4\)2(1)/c,a = b = 10.641(1) Å, c = 18.942(1) Å, V = 2144.6(2) Å3, ρcalcd = 1.627 g/cm3, Z = 4. In the structure of II, 2D cationic layers of fused square rings exist; the rings consist of four Ag+ cations linked by four bridging ligands of diethylpyrazine Et2Pyz. The coordination polyhedron of the Ag+ ion is an irregular four-vertex polyhedron.  相似文献   

15.
Coordination polymers [AgCF3CO2(2,3-Et2Pyz)](I)(2,3-Et2Pyz-C8H12N2) and [AgCF3CO2(Bpeta)] (II) (Bpeta is 4′4-bipyridylethane, C12H12N2) are synthesized. Their structures are determined. The crystals of compound I are monoclinic, space group P2(1)/n, a = 7.185(1), b = 14.754(1), c = 12.317(1)Å, β = 97.09(1)°, V = 1295.7(2) Å3, ρcalcd = 1.831 g/cm3, Z = 4. Structure I consists of infinite chains of doubled polymeric chains joined by silver carboxylate dimers [[Ag2(CF3CO2)2(Et2Pyz)2]. The coordination polyhedron of Ag+ is a distorted tetrahedron. The crystals of compound II are orthorhombic, space group Pbca, a = 13.555(3), b = 13.991(3), c = 16.449(3) Å, V = 3119.5(11) Å3, ρcalcd = 1.725 g/cm3, Z = 8. Doubled polymeric chains with the Ag…Ag bond (3.16 Å) are also formed in structure II. Supramolecular layers are formed in the structure due to the weak π-π-stacking interaction between the aromatic groups of chains. The CF3CO 2 ? anion is weakly bound to Ag+ (Ag-Oavg 2.790 Å).  相似文献   

16.
Heating of a hydrochloric acid solution of trans-PtPy(NH2CH2CN)Cl4 results in the hydrolysis of coordinated aminoacetonitrile to aminoacetic acid with the formation of a five-membered chelate ring attached to platinum through the nitrogen atom of the amino group and the oxygen atom of the carboxy group. X-ray diffraction analysis of [PtPy(NH2CH2COO)Cl3] is carried out. The crystals are monoclinic: space group C2/c, a = 21.704(2), b = 8.7027(7), c = 15.576(1) Å, β = 126.606(1)o, V = 2361.8(3) Å3, Z = 8; R hkl = 0.057, wR = 0.141. In the neutral complex, the Pt atom has a distorted octahedral coordination. The equatorial plane is formed by a Cl atom (Pt-Cl, 2.284(3) Å), the N atom of the Py molecule (Pt-N, 2.062(8) Å), and the N and O atoms of the bidentate-chelating ligand (Pt-N, 2.039(8); Pt-O, 2.026(7) Å); two Cl atoms are arranged in the apical positions (Pt-Cl, 2.301(3) and 2.312(3) Å). The five-membered chelate ring has a flattened gauche conformation with an NCCO torsion angle of 19(1)°.  相似文献   

17.
Two complexes [Zn(SALIMP)(CH3CO2)]2 (1) and [Cu(SALIMP)Cl] (2) are obtained by the reactions of zinc(II) and copper(II) salts with a tridentate Schiff base ligand 2-[[(2-pyridinylmethyl) imino]methyl]phenol (HSALIMP). Their structure is determined by single crystal X-ray diffraction. Data for complex 1: C30H28N4O6Zn2, CCDC number: 668213, M r = 671.3, monoclinic, C2/c, with a = 34.670(5) Å, b = 15.266(2) Å, c = 23.464(4) Å, β = 114.045(2)°, V = 11341(3) Å3, Z = 16, F(000) = 5504, GOOF(F 2) = 0.894, the final R = 0.0520 and wR = 0.1272 for 10515 observed reflections with I > 2σ(I); complex 2: C13H12N2OClCu, CCDC number: 668211, M r = 311.24, triclinic, P-1, with a = 7.4050(8) Å, b = 10.2369(11) Å, c = 16.2873(17) Å, α = 87.728(2)°, β = 87.818(2)°, γ = 78.279(2)°, V = 1207.4(2) Å3, Z = 4, F(000) = 632, GOOF(F 2) = 1.077, the final R = 0.0326 and wR = 0.0381 for 4209 observed reflections with I > 2σ(I).  相似文献   

18.
New ferrites ErMFe2O5 (M = Li, Na, K) were synthesized from erbium and iron(III) oxides and lithium, sodium, and potassium carbonates by solid-state annealing. According to X-ray powder diffraction, these compounds crystallize in the orthorhombic system with the following unit cell parameters: ErLiFe2O5, a = 10.510 Å, b = 10.776 Å, c = 14.270 Å, V 0 = 1616.16 Å3; Z = 16, V subcell 0 = 101.01 Å3, ρX = 6.01 g/cm3, ρpycn = 5.97 ± 0.05 g/cm3; ErNaFe2O5, a = 10.519 Å, b = 10.785 Å, c = 15.510 Å, V 0 = 1759.56 Å3, Z = 16, V subcell 0 = 109.90 Å3, ρX = 5.77 g/cm3, ρpycn = 5.72 ± 0.08 g/cm3; ErKFe2O5, a = 10.050 Å, b = 11.320 Å, c = 15.480 Å, V 0 = 1937.33 Å3, Z = 16, V subcell 0 = 121.08 Å3, ρX = 5.46 g/cm3, ρpycn = 5.41 ± 0.04 g/cm3.  相似文献   

19.
The complex [Co(2-Me-Pyz)2(H2O)4](NO3)2 is synthesized and its structure is determined. The crystals are monoclinic: space group P21/n, a = 10.685(2) Å, b = 6.837(1), c = 12.515(3) Å, β = 91.84(3)°, V = 913.8(3) Å3, ρcalcd = 1.042 g/cm 3, Z = 2. The Co2+ ion (in the inversion center) is coordinated at the vertices of the distorted octahedron by two nitrogen atoms of methylpyrazine and four oxygen atoms of the water molecules (Co(1)–N(1) 2.180(3), average Co(1)–O(w) 2.079(3) Å, angles at the Co atom 87.9(1)–92.1(1)°). Supramolecular pseudometallocycles are formed in the structure through the O(w)–H…N(1) hydrogen bonds between the coordinated H2O molecules and the terminal nitrogen atoms of the 2-methylpyrazine molecules. Their interaction results in the formation of supramolecular layers joined by the NO3 groups into a three-dimensional framework.  相似文献   

20.
A paramagnetic (μef = 3.86 BM) complex Cr(i-Bu2PS2)3 (I) has been synthesized. Single crystals I were grown, and the crystal structure of the compound was determined from X-ray diffraction data (X8 APEX diffractometer, MoK α radiation, 4516 F hkl , R = 0.0604). Monoclinic crystals, space group P21/n, unit cell parameters a = 14.2665(5) Å, b = 11.4400(4) Å, c = 23.1299(8) Å, β = 90.245(1)°, V = 3775.0(2) Å3, Z = 4, d calc = 1.196 g/cm3. The structure is based on discrete mononuclear molecules. The coordination polyhedron of the Cr atom is a distorted S6 octahedron formed from the S atoms of three cyclic bidentate ligands — i-Bu2PS 2 ions. Electron spectroscopy data correspond to the octahedral structure of the CrS6 chromophore. Original Russian Text Copyright ? 2007 by E. A. Sankova, L. A. Glinskaya, T. E. Kokina, R. F. Klevstova, and S. V. Larionov __________ Translated from Zhurnal Strukturnoi Khimii, Vol. 48, No. 2, pp. 374–378, March–April, 2007.  相似文献   

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