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1.
Jaromír Marek Jn Van
o Oga vajlenov 《Acta Crystallographica. Section C, Structural Chemistry》2003,59(12):m509-m511
The title polymeric compound, catena‐poly[dipotassium [bis[μ‐N‐salicylidene‐β‐alaninato(2−)]‐κ4O,N,O′:O′′;κ4O′′:O,N,O′‐dicopper(II)]‐di‐μ‐isothiocyanato‐κ2N:S;κ2S:N], {K[Cu(NCS)(C10H9NO3)]}n, consists of [isothiocyanato(N‐salicylidene‐β‐alaninato)copper(II)]− anions connected through the two three‐atom thiocyanate (μ‐NCS) and the two anti,anti‐μ‐carboxylate bridges into infinite one‐dimensional polymeric anions, with coulombically interacting K+ counter‐ions with coordination number 7 constrained between the chains. The CuII atoms adopt a distorted tetragonal–bipyramidal coordination, with three donor atoms of the tridentate Schiff base and one N atom of the bridging μ‐NCS ligand in the basal plane. The first axial position is occupied by a thiocyanate S atom of a symmetry‐related μ‐NCS ligand at an apical distance of 2.9770 (8) Å, and the second position is occupied by an O atom of a bridging carboxylate group from an adjacent coordination unit at a distance of 2.639 (2) Å. 相似文献
2.
Harald Krautscheid Stefan Gerber 《Acta Crystallographica. Section C, Structural Chemistry》2001,57(7):781-783
The anions of the title compounds contain [Ag(SCN)4] units, with the S atoms coordinating to Ag+ in a tetrahedral arrangement. Whereas in the isolated anions of tripotassium tetrathiocyanatoargentate(I), K3[Ag(SCN)4], (I), all SCN? groups are bonded as terminal ligands, in tetrapotassium di‐μ‐thiocyanato‐S:S‐bis[dithiocyanatoargentate(I)], K4[Ag2(SCN)6], (II), two AgS4 tetrahedra share one common edge. In poly[potassium [argentate(I)‐di‐μ‐thiocyanato‐S:S]], K[Ag(SCN)2], (III), edge‐ and vertex‐sharing of AgS4 tetrahedra results in infinite [Ag(SCN)2]? layers. 相似文献
3.
M. Enriqueta Díaz de Vivar Sergio Baggio María Teresa Garland Ricardo Baggio 《Acta Crystallographica. Section C, Structural Chemistry》2007,63(3):m123-m125
catena‐Poly[[[tetraaquazinc(II)]‐μ‐4,4′‐bipyridine‐κ2N:N′] [[μ‐thiosulfato‐κ2O:S‐bis[(thiosulfato‐κS)zinc(II)]]‐di‐μ‐4,4′‐pyridine‐κ4N:N′] dihydrate], {[Zn(C10H8N2)(H2O)4][Zn2(S2O3)3(C10H8N2)2]·2H2O}n, is a polymeric zinc complex built up from thiosulfate‐containing anionic chains, where the Zn atom is tetrahedrally coordinated, and aqua‐containing cationic chains incorporating octahedrally coordinated Zn. In each type of chain, the 4,4′‐bipyridine units act as spacers, and the chains run along three non‐intersecting almost orthogonal directions in space. The profusion of hydrogen‐bond donors (all the H atoms of the water molecules) and acceptors (the thiosulfate O and S atoms) generates a very complex hydrogen‐bonding scheme. 相似文献
4.
Hyoung‐Sil Moon Chong‐Hyeak Kim Sueg‐Geun Lee 《Acta Crystallographica. Section C, Structural Chemistry》2000,56(4):425-426
In the title compound, catena‐poly[[bis(aniline‐N)cadmium(II)]‐di‐μ‐thiocyanato‐S:N;N:S], [Cd(SCN)2(C6H7N)2], the CdII atom lies on an inversion centre and is in a distorted octahedral geometry. The coordination sphere contains two thiocyanate (SCN) S atoms, two isothiocyanate (NCS) N atoms and two aniline N atoms. The six‐coordinated Cd atoms run parallel to the b axis and are doubly bridged with neighbouring Cd atoms by SCN and NCS ligands. Thus, this complex has a one‐dimensional coordination polymeric chain structure in which the aniline ligand is in the trans conformation. 相似文献
5.
Eleonora Freire Sergio Baggio Juan Carlos Muoz Ricardo Baggio 《Acta Crystallographica. Section C, Structural Chemistry》2002,58(8):m455-m458
The structure of bis(1,10‐phenanthroline‐κ2N,N′)(thiosulfato‐κ2O:S)manganese(II) methanol solvate, [Mn(S2O3)(C12H8N2)2]·CH3OH, is made up of Mn2+ centers coordinated to two bidentate phenanthroline (phen) groups and an S,O‐chelating thiosulfate anion, forming monomeric entities. The structure of catena‐poly[[diaqua(2,9‐dimethyl‐1,10‐phenanthroline‐κ2N,N′)manganese(II)]‐μ‐thiosulfato‐κ2O:S], [Mn(S2O3)(C14H12N2)(H2O)2]n, is polymeric, consisting of Mn(dmph)(H2O)2 units (dmph is 2,9‐dimethyl‐1,10‐phenanthroline) linked by thiosulfate anions acting in an S,O‐chelating manner. 相似文献
6.
Xue Li Jian‐Min Dou Ying Liu Lan‐Ying Zhu Pei‐Ju Zheng 《Acta Crystallographica. Section C, Structural Chemistry》2000,56(10):1185-1187
The novel PtII–dibenzo‐18‐crown‐6 (DB18C6) title complex, μ‐[tetrakis(thiocyanato‐S)platinum(II)]‐N:N′‐bis{[2,5,8,15,18,21‐hexaoxatricyclo[20.4.0.19,14]hexacosa‐1(22),9(14),10,12,23,25‐hexaene‐κ6O]potassium(I)}, [K(C20H24O6)]2[Pt(SCN)4], has been isolated and characterized by X‐ray diffraction analysis. The structure analysis shows that the complex displays a quasi‐one‐dimensional infinite chain of two [K(DB18C6)]+ complex cations and a [Pt(SCN)4]2? anion, bridged by K+?π interactions between adjacent [K(DB18C6)]+ units. 相似文献
7.
Chen‐Xin Cai Yun‐Qi Tian Yi‐Zhi Li Xiao‐Zeng You 《Acta Crystallographica. Section C, Structural Chemistry》2002,58(8):m459-m460
In the title mononuclear cobalt complex, bis(2,6‐dimethyl‐1H,7H‐benzo[1,2‐d:4,5‐d′]diimidazole‐κN3)bis(thiocyanato‐κN)cobalt(II), [CoII(NCS)2(DMBDIZ)2] or [Co(NCS)2(C10H10N4)2], the cobalt(II) ion is coordinated to four N atoms, from two thiocyanate anions and two DMBDIZ ligands, in a distorted tetrahedral geometry. In the DMBDIZ ligand, the two imine N atoms are positioned cis with respect to one another. The crystal packing of the complex is dominated by both hydrogen bonding, involving two N—H?N and two N—H?S interactions, and aromatic π–π stacking. 相似文献
8.
Zhong‐Lu You 《Acta Crystallographica. Section C, Structural Chemistry》2005,61(6):m295-m297
The two title complexes, catena‐poly[[{2,2′‐[1,3‐propanediylbis(nitrilomethylidyne)]diphenolato}cobalt(III)]‐μ‐azido], [Co(C17H16N2O2)(N3)]n, (I), and catena‐poly[[{2,2′‐[1,3‐propanediylbis(nitrilomethylidyne)]diphenolato}cobalt(III)]‐μ‐thiocyanato], [Co(C17H16N2O2)(NCS)]n, (II), are isomorphous polynuclear cobalt(III) compounds. In both structures, the CoIII atom is six‐coordinated in an octahedral configuration by two N atoms and two O atoms of one Schiff base, and two terminal N or S atoms from two bridging ligands. The [N,N′‐bis(salicylidene)propane‐1,3‐diaminato]cobalt(III) moieties are linked by the bridging ligands, viz. azide in (I) and thiocyanate in (II), giving zigzag polymeric chains with backbones of the type [–Co—N—N—N—Co]n in (I) or [–Co—N—C—S—Co]n in (II) running along the c axis. 相似文献
9.
Bao‐Zong Li Xun‐Gao Liu Yan‐Fen Peng Bao‐Long Li Yong Zhang 《Acta Crystallographica. Section C, Structural Chemistry》2006,62(2):m41-m44
In the title complex, poly[cadmium(II)‐μ2‐1,4‐bis(1,2,4‐triazol‐1‐ylmethyl)benzene‐di‐μ2‐thiocyanato], [Cd(NCS)2(C12H12N6)]n, the CdII atom lies on an inversion centre in a distorted octahedral environment. Four N atoms from the thiocyanate and 1,4‐bis(1,2,4‐triazol‐1‐ylmethyl)benzene (bbtz) ligands occupy the equatorial positions, and two S atoms from symmetry‐related thiocyanate ligands occupy the axial positions. The benzene ring of the bbtz ligand lies about an inversion centre. Single thiocyanate bridges link the CdII atoms into two‐dimensional sheets containing novel 16‐membered [Cd4(μ‐NCS‐N:S)4] rings. The bbtz ligands further link these two‐dimensional sheets into an unprecedented covalent three‐dimensional network for the cadmium–thiocyanate system. 相似文献
10.
Oscar E. Piro Eduardo E. Castellano Roberto C. V. Piatti Agustín E. Bolzn Alejandro J. Arvia 《Acta Crystallographica. Section C, Structural Chemistry》2002,58(4):m252-m255
The crystal structures of two salts of bis(thiourea)gold(I) complexes, namely bis(thiourea‐κS)gold(I) chloride, [Au(CH4N2S)2]Cl, (I), and bis[bis(thiourea‐κS)gold(I)] sulfate, [Au(CH4N2S)2]2SO4, (II), have been determined. The chloride salt, (I), is isomorphous with the corresponding bromide salt, although there are differences in the bonding. The AuI ion is located on an inversion centre and coordinated by two symmetry‐related thiourea ligands through the lone pairs on their S atoms [Au—S 2.278 (2) Å and Au—S—C 105.3 (2)°]. The sulfate salt, (II), crystallizes with four independent [Au(CH4N2S)2]+ cations per asymmetric unit, all with nearly linear S—Au—S bonding. The cations in (II) have similar conformations to that found for (I). The Au—S distances range from 2.276 (3) to 2.287 (3) Å and the Au—S—C angles from 173.5 (1) to 177.7 (1)°. These data are relevant in interpreting different electrochemical processes where gold–thiourea species are formed. 相似文献
11.
Sergio Baggio Ricardo Baggio M. Enriqueta Díaz de Vivar María Teresa Garland 《Acta Crystallographica. Section C, Structural Chemistry》2007,63(4):m153-m156
catena‐Poly[[[tetraaquanickel(II)]‐μ‐4,4′‐bipyridine‐κ2N:N′] thiosulfate dihydrate], {[Ni(C10H8N2)(H2O)4]S2O3·2H2O}n, (I), and catena‐poly[[[tetraaquanickel(II)]‐μ‐4,4′‐bipyridine‐κ2N:N′] sulfate methanol solvate monohydrate], {[Ni(C10H8N2)(H2O)4]SO4·CH4O·H2O}n, (II), are built up of {[Ni(4,4′‐bipy)(H2O)4]2+}n chains (4,4′‐bipy is 4,4′‐bipyridine) interwoven in an unusual P31 fashion. Voids are filled by the corresponding counter‐anions and solvate molecules, defining a complex three‐dimensional network surrounding them. In both structures, the cationic chains evolve around a set of twofold axes passing through the NiII ions and bisecting the aromatic amines through their N (and their opposite C) atoms. 相似文献
12.
Yan‐Fen Peng Xun‐Gao Liu Bao‐Zong Li Yong Zhang Bao‐Long Li 《Acta Crystallographica. Section C, Structural Chemistry》2005,61(7):m333-m336
In the title complex, poly[copper(II)‐di‐μ2‐thiocyanato‐μ2‐1,4‐bis(1,2,4‐triazol‐1‐ylmethyl)benzene], [Cu(NCS)2(C12H12N6)]n, the CuII atom lies on an inversion centre in a tetragonally distorted octahedral environment. Four N atoms from thiocyanate and 1,4‐bis(1,2,4‐triazol‐1‐ylmethyl)benzene (bbtz) ligands fill the equatorial positions, and S atoms from symmetry‐related thiocyanate ligands fill the axial positions. The benzene ring of the bbtz ligand lies about an inversion centre. Single thiocyanate bridges link the CuII atoms into two‐dimensional sheets containing an unprecedented 16‐membered [Cu4(μ‐NCS‐N:S)4] ring. The bbtz ligands further link the two‐dimensional sheets into a three‐dimensional network. 相似文献
13.
Miguel Harvey Sergio Baggio Helena Pardo Ricardo Baggio 《Acta Crystallographica. Section C, Structural Chemistry》2004,60(2):m79-m81
The structure of the novel cadmium phenanthroline thiosulfate poly[[(1,10‐phenanthroline‐κ2N,N′)cadmium(II)]‐μ3‐thiosulfato‐κ3S:S:O], [Cd(S2O3)(C12H8N2)]n, with a pentacoordinated Cd centre, is reported. It forms linear chains built up around a 21 axis and is isostructural with the known bipyridine homologue. The structure is also compared with a previously reported closely related monoaqua monohydrated phase, where the Cd2+ cation is hexacoordinated. The incidence of weak C—H⋯O interactions in the determination of its general packing properties is discussed. 相似文献
14.
You‐Ming Zhang Liang Xian Tai‐Bao Wei 《Acta Crystallographica. Section C, Structural Chemistry》2003,59(11):m473-m474
The title complex, chlorobis{ethyl N‐[(4‐methylanilino)thiocarbonyl]carbamate‐κS}copper(I), [CuCl(C11H14N2O2S)2], was synthesized by the reaction of cupric chloride with the corresponding thiourea derivative. The complex has imposed crystallographic m symmetry and the CuI coordination environment is trigonal planar, formed by two S atoms and one Cl atom. The formation of intramolecular hydrogen bonds promotes the stability of the complex. 相似文献
15.
Golam Mostafa Arunendu Mondal Inamur R. Laskar A. J. Welch N. Ray Chaudhuri 《Acta Crystallographica. Section C, Structural Chemistry》2000,56(2):146-148
The title complex, poly[bis[N‐(2‐aminoethyl)‐N‐methyl‐1,2‐ethanediamine]hexa‐μ‐thiocyanato‐tricadmium(II) monohydrate], [Cd3(NCS)6(medien)2]n·nH2O [medien is N,N‐bis(2‐aminoethyl)methylamine, C5H16N3], adopts a three‐dimensional inorganic polymeric network structure. Two cadmium centres (Cd1 and Cd2) are linked to each other via thiocyanate bridges. The environment of the Cd1 atom involves only S atoms, making it soft, whereas the environment of the Cd2 atom involves only N atoms, making it hard. 相似文献
16.
Günter Reck Roland Becker 《Acta Crystallographica. Section C, Structural Chemistry》2004,60(3):m134-m136
Bis(N,N‐di‐n‐butyldithiocarbamato‐κ2S,S′)(1,10‐phenanthroline‐κ2N,N′)zinc(II) ethanol hemisolvate, [Zn(C9H18NS2)2(C12H8N2)]·0.5C2H6O, (I), and bis(N,N‐di‐n‐hexyldithiocarbamato‐κ2S,S′)bis(1,10‐phenanthroline‐κ2N,N′)calcium(II), [Ca(C13H26NS2)2(C12H8N2)2], (II), are mixed‐ligand complexes. In the first compound, the Zn atom has a distorted octahedral coordination, while in the second compound, the Ca atom is eight‐coordinate, with four S and four N atoms forming a highly distorted cube. 相似文献
17.
Vukadin M. Leovac Goran A. Bogdanovi Valerija I. eljevi Vladimir Divjakovi 《Acta Crystallographica. Section C, Structural Chemistry》2000,56(8):936-938
The title compound, [diacetylpyridine bis(S‐methylisothiosemicarbazonato)]iodonickel(II), [Ni(C13H18N7S2)I], is the first example of a complex involving the 2N coordination of the isothiosemicarbazide moiety. 2,6‐Diacetylpyridine bis(S‐methylisothiosemicarbazone), as a potentially pentadentate ligand (N5), is coordinated as a tetradentate species, whereby one (deprotonated) isothiosemicarbazide moiety is coordinated in the usual way (1N4N), but the other (neutral) is bonded via the 2N atom only, the fourth ligator being the pyridine nitrogen. The difference in coordination mode of the isothiosemicarbazide moiety is reflected in the 1N—2N bond lengths of 1.359 (4) and 1.379 (3) Å in the deprotonated and undeprotonated moieties, respectively. The structure contains three fused chelate rings in a 5:5:6 arrangement. The six‐membered ring has a non‐planar conformation. 相似文献
18.
Andrew D. Bond Christine J. McKenzie 《Acta Crystallographica. Section C, Structural Chemistry》2005,61(12):m519-m522
Two one‐dimensional zinc‐based coordination polymers containing cyanate anions are reported. catena‐Poly[sodium [[tricyanatozinc(II)]‐μ‐1,4‐diazabicyclo[2.2.2]octane‐κ2N:N′]], {Na[Zn(NCO)3(C6H12N2)]}n, consists of linear [tricyanatozinc(II)]‐μ‐1,4‐diazabicyclo[2.2.2]octane strands in which the Zn2+ cations adopt trigonal–bipyramidal coordination on sites of m2 point symmetry. Na+ cations lie between the strands on sites of m point symmetry, coordinated in a distorted octahedral geometry by six O atoms of the cyanate anions. catena‐Poly[[dicyanatozinc(II)]‐μ‐4,4′‐bipyridine‐κ2N:N′], [Zn(NCO)2(C10H8N2)]n, crystallizes in the space group P21/n with Z′ = 5. The structure consists of zigzag strands formed by Zn2+ cations linked via 4,4′‐bipyridine. Each Zn2+ cation adopts a tetrahedral coordination, with two sites occupied by 4,4′‐bipyridine and two cyanate anions completing the coordination sphere. The structure is closely comparable with the thiocyanate and halide analogues [ZnX2(C10H8N2)] (X = NCS, Cl or Br). 相似文献
19.
Orde Q. Munro Nicole Pearson 《Acta Crystallographica. Section C, Structural Chemistry》2003,59(10):m407-m412
The title salt, (1,4,7,10,13,16‐hexaoxacyclooctadecane‐κ6O)[(isothiocyanato)triphenylborato‐κS]potassium(I), [K(C19H15BNS)(C12H24O6)] or [K(SCNBPh3)(18‐crown‐6)], where 18‐crown‐6 is 1,4,7,10,13,16‐hexaoxacyclooctadecane and [SCNBPh3]− is the (isothiocyanato)triphenylborate anion, exhibits a supramolecular structure that is best described as a helical coordination polymer or molecular screw. This unusual supramolecular structure is based on a framework in which the SCN− ion bridges the chelated K+ ion and the B atom of BPh3 in a μ2 fashion. The X‐ray crystal structure of the title salt has been determined at 100 (1) and 293 (2) K. The K+ ion exhibits axial ligation by the S atom of the [SCNBPh3]− anion, with a K—S distance of 3.2617 (17) Å (100 K). The trans‐axial ligand is an unexpected η2‐bound C=C bond of a phenyl group (meta‐ and para‐C atoms) that belongs to the BPh3 moiety of a neighboring molecule. The K—C bond distances span the range 3.099 (3)–3.310 (3) Å (100 K) and are apparently retained in CDCl3 solution (as evidenced by 13C NMR spectroscopy). By virtue of the latter interaction, the supramolecular structure is a helical coordination polymer, with the helix axis parallel to the b axis of the unit cell. IR spectroscopy and semi‐empirical molecular orbital (AM1) calculations have been used to investigate further the electronic structure of the [SCNBPh3]− ion. 相似文献
20.
Huai‐Gang Zhu Guang Yang Xiao‐Ming Chen Seik Weng Ng 《Acta Crystallographica. Section C, Structural Chemistry》2000,56(10):e430-e431
Bridging by the two thiocyanato groups in centrosymmetric six‐coordinate bis(thiocyanato)bis(diphenylthiourea)cadmium(II) dihydrate leads tothe formation of eight‐membered [Cd—SCN→Cd—SCN→] rings that are linked at the metal atom to furnish chains running parallel to the a axis, i.e {[Cd(NCS)2(C13H12N2S)2]·2H2O}n. 相似文献