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1.
Ri‐Cheng Xuan Min Xu Dong‐Ping Cheng 《Acta Crystallographica. Section C, Structural Chemistry》2006,62(12):m587-m589
In the title compound, [CuCl2(C9H12N2O)], the CuII atom is coordinated by two Cl− anions and two N atoms of one O‐ethyl 3‐methylpyridine‐2‐carboximidic acid molecule in a slightly distorted square‐planar geometry, with Cu—N distances of 2.0483 (17) and 1.9404 (18) Å, and Cu—Cl distances of 2.2805 (10) and 2.2275 (14) Å. In addition, each CuII atom is connected by one Cl− anion and the CuII atom from a neighbouring molecule, with Cu⋯Cl and Cu⋯Cu distances of 2.9098 (13) and 3.4022 (12) Å, respectively, and, therefore, a centrosymmetric dimer is formed. Adjacent molecular dimers are connected by π–π stacking interactions between pyridine rings to form a zigzag molecular chain. The molecular chains are also enforced by N—H⋯Cl and C—H⋯Cl interactions. 相似文献
2.
Ying Xu Hong‐Xi Li Wen‐Hua Zhang Yong Zhang Jian‐Ping Lang 《Acta Crystallographica. Section C, Structural Chemistry》2005,61(1):m4-m6
In the title compound, [Cu2I2(C11H16N4)2], each of the two crystallographically equivalent Cu atoms is tetrahedrally coordinated by two N atoms from one 1,1′‐methylenebis(3,5‐dimethyl‐1H‐pyrazole) ligand and two bridging iodide anions. The molecule has a crystallographic center of symmetry located at the mid‐point of the Cu·Cu line. One H atom of the CH2 group of the 1,1′‐methylenebis(3,5‐dimethyl‐1H‐pyrazole) ligand interacts with an iodide ion in an adjacent molecule to afford pairwise intermolecular C—H·I contacts, thereby forming chains of molecules running along the [101] direction. 相似文献
3.
Nack‐Do Sung Ki‐Seob Yun Jin‐Gyu Kim Il‐Hwan Suh 《Acta Crystallographica. Section C, Structural Chemistry》2000,56(9):e370-e371
The title compound, μ‐aqua‐1:2κ2O‐pentaaqua‐1κ2O,2κ3O‐μ‐3,6‐bis(6‐methyl‐2‐pyridyl)pyridazine‐1κ2N1,N6:2κ2N2,N3‐chloro‐1κCl‐dinickel(II) trichloride trihydrate, [Ni2Cl(C16H14N4)(H2O)6]Cl3·3H2O, consists of two NiII atoms, a 3,6‐bis(6‐methyl‐2‐pyridyl)pyridazine molecule, four Cl atoms and nine water molecules. The two Ni atoms are octahedrally coordinated by N and Cl atoms, and by water molecules, and the three six‐membered rings, a pyridazine and two picolines, are planar to within 0.181 (3) Å. The crystal structure is stabilized by an intra‐ and intermolecular hydrogen‐bonding scheme involving water–water and water–chlorine interactions. 相似文献
4.
Bao‐Zhong Zhao Xiang‐Rong Hao Zhan‐Gang Han Qiang Fu Ya‐Guang Chen 《Acta Crystallographica. Section C, Structural Chemistry》2005,61(1):m48-m50
A novel copper(II) coordination polymer, poly[[[aquacopper(II)]‐μ3‐2,2′‐bipyridyl‐3,3′‐dicarboxylato‐κ4N,N′:O:O′] dihydrate], {[Cu(C12H6N2O4)(H2O)]·2H2O}n, was obtained by the reaction of CuCl2·2H2O and 2,2′‐bipyridyl‐3,3′‐dicarboxylic acid (H2L) in water. In the molecule, each CuII atom is five‐coordinated and lies at the centre of a square‐pyramidal basal plane, bridged by three L ligands to form a two‐dimensional (4,4)‐network. Each L moiety acts as a bridging tetradentate ligand, coordinating to three CuII atoms through its two aromatic N atoms and two O atoms of the two carboxyl groups. The two‐dimensional square‐grid sheets superimpose in an off‐set fashion through the inorganic water layer. 相似文献
5.
Sujittra Youngme Jaturong Phatchimkun Narongsak Chaichit 《Acta Crystallographica. Section C, Structural Chemistry》2006,62(6):m267-m268
In the structure of the title complex, [Cu(C2O4)(C10H9N3)(H2O)]·H2O, the CuII atom displays a square‐pyramidal geometry, being coordinated by two N atoms from the di‐2‐pyridylamine ligand, two O atoms from the oxalate group and one O atom of a water molecule. The complex molecules are linked to form a three‐dimensional supramolecular array by hydrogen‐bonding interactions between coordinated/uncoordinated water molecules and the uncoordinated oxalate O atoms of neighboring molecules. 相似文献
6.
Mamiko Odoko Ai Kusano Naomi Oya Nobuo Okabe 《Acta Crystallographica. Section C, Structural Chemistry》2002,58(4):m215-m216
The crystal structure of catena‐poly[[(6‐carboxypyridine‐2‐carboxylato‐κ3O,N,O′)lithium(I)]‐μ‐aqua‐κ2O:O], [Li(C7H4NO4)(H2O)]n, contains the Li+ ion coordinated to two O atoms and the N atom of the 6‐carboxypyridine‐2‐carboxylate ligand, and to two water O atoms, forming a pentavalent coordination geometry. The molecule resides on a mirror plane which contains the Li and N atoms, the para‐CH unit, and the O atom of the coordinated water molecule. The O atom of the water molecule is coordinated to two Li atoms, forming an infinite polymeric chain. 相似文献
7.
Kai Liang Yi‐Zhi Li He‐Gen Zheng Xin‐Quan Xin 《Acta Crystallographica. Section C, Structural Chemistry》2003,59(8):m310-m312
In the title compound, [1,4‐bis(diphenylphosphino)butane‐2κ2P,P′]di‐μ‐thio‐1:2κ4S‐dithio‐1κ2S‐palladium(II)tungsten(VI) N,N′‐dimethylformamide hemisolvate hemihydrate, [PdWS4(C28H28P2)]·0.5C3H7NO·0.5H2O, the Pd atom is coordinated by two S atoms from the distorted‐tetrahedral [WS4]2− anion and two P atoms from the dppb molecule [dppb is 1,4‐bis(diphenylphosphino)butane] in an approximately square‐planar configuration. A puckered seven‐membered ring is formed by the Pd atom and the dppb ligand. 相似文献
8.
Wen‐Na Zhao Jian‐Wei Zou Qing‐Shen Yu 《Acta Crystallographica. Section C, Structural Chemistry》2004,60(9):m443-m444
The title one‐dimensional chain nickel(II)–disulfide complex, [Ni(C14H8O4S2)(C5H5N)2(H2O)]n, has each NiII cation coordinated by two N atoms from two pyridine ligands, three carboxylate O atoms from two different dithiodibenzoate ligands and one O atom from a coordinated water molecule, in a distorted octahedral coordination geometry. Each dithiodibenzoate ion links two NiII cations through its carboxylate O atoms, making the structure polymeric. Hydrogen‐bond interactions between two shoulder‐to‐shoulder chains lead to the formation of a ladder‐like structure. 相似文献
9.
Hong‐Chang Liang Marcel M. Hetu Kraig A. Wheeler Lev N. Zakharov Arnold L. Rheingold 《Acta Crystallographica. Section C, Structural Chemistry》2006,62(11):m519-m521
In the title compound, [Zn(C2H3N)(C16H21N3O)](ClO4)2·H2O, the ZnII ion is coordinated by two pyridyl N atoms, one amine N atom, and an ethanol O atom from the N,N′,N′′,O‐tetradentate 2‐[bis(2‐pyridylethyl)amino]ethanol donor ligand. The fifth coordination site is filled by an acetonitrile N atom, and there is one solvent water molecule in the asymmetric unit. The 2+ charge of the cationic portion of the complex is balanced by two perchlorate counter‐anions. 相似文献
10.
Ayhan Elmali Ebru Kavlakoglu YalcÛn Elerman Ingrid Svoboda 《Acta Crystallographica. Section C, Structural Chemistry》2000,56(9):1097-1099
The title compound, aquachloro{4,4′‐dibromo‐2,2′‐[o‐phenylenebis(nitrilomethylidyne)]diphenolato‐O,N,N′,O′}iron(III)–chloro{4,4′‐dibromo‐2,2′‐[o‐phenylenebis(nitrilomethyli‐dyne)]diphenolato‐O,N,N′,O′}iron(III)–dimethylformamide (1/1/1), [FeCl(C20H12Br2N2O2)][FeCl(C20H12Br2N2O2)(H2O)]·C3H7NO, contains one independent five‐coordinate [FeCl(C20H12Br2N2O2)] monomer, one six‐coordinate [FeCl(C20H12Br2N2O2)(H2O)] monomer and a non‐coordinating dimethylformamide solvent molecule in the asymmetric unit. In the five‐coordinate monomer, the Fe atom shows distorted square‐pyramidal geometry, with the N and O atoms of the ligand at the base and the Cl atom at the apex of the pyramid. In the six‐coordinate monomer, the Fe atom is in a distorted octahedral geometry and coordinated by the donor atoms of the tetrafunctional ligand in the horizontal plane, and the coordination sphere is completed by the O atom of the water molecule and the Cl atom at the axial positions. The title compound contains intermolecular O—H?O hydrogen bonds. Apart from these hydrogen bonds, there are also intermolecular C—H?Cl and C—H?O contacts. 相似文献
11.
Mohammed Bakir 《Acta Crystallographica. Section C, Structural Chemistry》2001,57(10):1154-1156
The structure of the first metal compound of pyridyl N,N′-coordinated di-2-pyridyl ketone oxime (dpk-o), fac-tricarbonylchloro(di-2-pyridyl-κN ketone oxime)rhenium(I) dimethyl sulfoxide solvate, [ReCl(C11H9N2O)(CO)3]·C2H6OS, (I), is reported. The coordinated atoms (two N atoms from the pyridyl rings, three C atoms from the carbonyl groups and one Cl atom) are in a distorted octahedral arrangement, with the major distortion being due to the constraints associated with the binding of dpk-o. The packing of the molecules shows antiparallel tapes of (I), with a network of classical (O⃛H—O) and non-classical (O⃛H—C) hydrogen bonds between the dimethyl sulfoxide solvate molecule and the complexed metal moiety. 相似文献
12.
Varughese Philip E. Manoj M. R. Prathapachandra Kurup Munirathinam Nethaji 《Acta Crystallographica. Section C, Structural Chemistry》2005,61(11):m488-m490
The VV atom in the title complex, [V(C16H16N5S)O2], is five‐coordinate in a highly distorted square‐pyramidal geometry, with the pyridyl N, the azomethine N and the thiolate S atoms of the di‐2‐pyridyl ketone N4,N4‐(butane‐1,4‐diyl)thiosemicarbazone ligand and one oxo ligand occupying the basal coordination positions, while the second oxo ligand occupies the apical position. The molecules are interconnected by weak intermolecular interactions, mainly of the C—H⋯O type, involving the oxo atoms. 相似文献
13.
Andrew Hempel Norman Camerman Donald Mastropaolo Arthur Camerman 《Acta Crystallographica. Section C, Structural Chemistry》2000,56(8):1048-1049
In the title compound, dimethyl({5‐[2‐(1‐methylamino‐2‐nitroethenylamino)ethylthiomethyl]‐2‐furyl}methyl)ammonium chloride, C13H23N4O3S+·Cl?, protonation occurs at the dimethylamino N atom. The ranitidine molecule adopts an eclipsed conformation. Bond lengths indicate extensive electron delocalization in the N,N′‐dimethyl‐2‐nitro‐1,1‐ethenediamine system of the molecule. The nitro and methylamino groups are trans across the side chain C=C double bond, while the ethylamino and nitro groups are cis. The Cl? ions link molecules through hydrogen bonds. 相似文献
14.
Guohong Zhang Yongge Wei Ping Wang Hongyou Guo 《Acta Crystallographica. Section C, Structural Chemistry》2002,58(12):m605-m607
The title compound, [Co(C12H6N2O4)(H2O)2]n, has been hydrothermally synthesized and structurally characterized. It consists of polymeric chains of [Co{μ‐(2,2′‐bipyridyl‐3,3′‐dicarboxylato‐κ4N,N′:O,O′)}(H2O)2] units, in which each CoII cation is octahedrally coordinated by two chelating pyridyl N atoms, two chelating carboxyl O atoms from different carboxylate groups of another bipyridyl ligand, and two water molecules as terminal ligands. A crystallographic twofold axis parallel to the chain axis, passes through the Co atom. 相似文献
15.
J. Wilson Quail John A. Weil Malvinder P. Singh 《Acta Crystallographica. Section C, Structural Chemistry》2000,56(2):235-236
The title molecule (DMPH‐H), C8H9N5O6, was investigated to provide comparison with 2,2‐diphenyl‐1‐picrylhydrazine, which unlike DMPH‐H is readily oxidizable to form a well known stable free radical (DPPH). The structure shows essential differences in the configuration of the hydrazine‐N atoms, the ortho‐nitro group orientations and the crystal packing. The bond angles of the dimethylamino N atom [107.90 (13), 108.96 (12) and 112.21 (13)°] are consistent with a tetrahedral N atom and sp3 hybridization. 相似文献
16.
M. Ramos Silva J. A. Paixão A. Matos Beja L. Alte da Veiga 《Acta Crystallographica. Section C, Structural Chemistry》2001,57(1):7-8
The title compound, [CuCl2(C3H7N3O2)2], is a new copper(II) complex with glycocyamine [(diaminomethyleneamino)acetic acid], the first complex ever reported with this organic molecule. It is composed of discrete centrosymmetric coordinated CuII monomers, the Cu atoms being located at inversion centers. Each metal ion is square-planar coordinated by two Cl atoms and two glycocyamine O atoms. The coordinating glycocyamine molecule exists as a zwitterion, the H atom from the carboxyl group being transferred to the guanidinium group. A three-dimensional network of hydrogen bonds links the monomers and stabilizes the structure. 相似文献
17.
Xia Li Ying‐Quan Zou Hai‐Bin Song 《Acta Crystallographica. Section C, Structural Chemistry》2004,60(3):m110-m111
Each La3+ ion in the title complex, tetra‐μ‐2‐fluorobenzoato‐κ10O:O′;O:O,O′;O:O′;O,O′:O′‐bis[aqua(4,4′‐bipyridine‐κN)(2‐fluorobenzoato‐κO)lanthanum(II)], [La(C7H4FO2)6(C10H8N2)2(H2O)2], is coordinated by six O atoms from the carboxylate groups of five 2‐fluorobenzoate ligands, one O atom from a water molecule and one N atom from a 4,4′‐bipyridine molecule, thus forming a dimeric molecule. An infinite one‐dimensional dimeric supramolecular chain is formed via intermolecular hydrogen bonds. 相似文献
18.
Egla Y. Bivin‐Castro Sylvain Berns Jaime Escalante Guillermo Mendoza‐Díaz 《Acta Crystallographica. Section C, Structural Chemistry》2004,60(5):m205-m207
In the cationic complex present in the title compound, chloro[2‐(4‐imidazolyl‐κN1)ethylamine‐κN](1,10‐phenanthroline‐κ2N,N′)copper(II) chloride monohydrate, [CuCl(C5H9N3)(C12H8N2)]Cl·H2O, the metal centre adopts a five‐coordinate geometry, ligated by the two phenanthroline N atoms, two amine N atoms of the histamine ligand (one aliphatic and one from the imidazole ring) and a chloro ligand. The geometry around the Cu atom is a distorted compressed trigonal bipyramid, with one phenanthroline N and one imidazole N atom in the axial positions, and the other phenanthroline N atom, the histamine amine N atom and the chloro ligand in the equatorial positions. The structure includes an uncoordinated water molecule, and a Cl− ion to complete the charge. The water molecule is hydrogen bonded to both Cl− ions (coordinated and uncoordinated), and exhibits a close Cu⋯H contact in the equatorial plane of the bipyramid. 相似文献
19.
Maria Gdaniec Igor Bensemann Tadeusz Pooski 《Acta Crystallographica. Section C, Structural Chemistry》2002,58(12):o735-o738
The 1:1 complexes N,N′‐bis(2‐pyridyl)benzene‐1,4‐diamine–anilic acid (2,5‐dihydroxy‐1,4‐benzoquinone) (1/1), C16H14N4·C6H4O4, (I), and N,N′‐bis(2‐pyridyl)biphenyl‐4,4′‐diamine–anilic acid (1/1), C22H18N4·C6H4O4, (II), have been prepared and their solid‐state structures investigated. The component molecules of these complexes are connected via conventional N—H?O and O—H?N hydrogen bonds, leading to the formation of an infinite one‐dimensional network generated by the cyclic motif R(9). The anilic acid molecules in both crystal structures lie around inversion centres and the observed bond lengths are typical for the neutral molecule. Nevertheless, the pyridine C—N—C angles [120.9 (2) and 120.13 (17)° for complexes (I) and (II), respectively] point to a partial H‐atom transfer from anilic aicd to the bispyridylamine, and hence to H‐atom disorder in the OHN bridge. The bispyridylamine molecules of (I) and (II) also lie around inversion centres and exhibit disorder of their central phenyl rings over two positions. 相似文献
20.
Dmitry Yu. Naumov Dmitrii S. Yufit Elena V. Boldyreva Judith A. K. Howard 《Acta Crystallographica. Section C, Structural Chemistry》2001,57(7):790-792
The crystal structure of poly[copper(II)‐di‐μ‐hypophosphito‐μ‐urea], [Cu(H2PO2)2(CH4N2O)]n, has been determined at 293, 100 and 15 K. The geometry of the hypophosphite anion is very close to ideal, with point symmetry mm2. Each Cu atom lies on an inversion centre and is coordinated to six O atoms from four hypophosphite anions and two urea molecules, forming a tetragonal bipyramid. The unique urea molecule lies on a twofold axis. Each hypophosphite anion in the structure is coordinated to two Cu atoms. The hypophosphite anions, urea molecules and CuII cations form polymeric ribbons. The CuII cations in the ribbon are linked together by two hypophosphite anions and a urea molecule, which is coordinated to Cu via an O atom. The ribbons are linked to each other by N—H?O hydrogen bonds and form polymeric layers. 相似文献