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1.
Ken Sakai Yuichi Uchida Takashi Kajiwara Tasuku Ito 《Acta Crystallographica. Section C, Structural Chemistry》2004,60(2):m65-m68
In the title compound, [RuII(C10H8N2)3]2[FeIII(CN)6]Cl·8H2O, the [Ru(bpy)3]2+ (bpy is 2,2′‐bipyridine) cations and water molecules afford intriguing microporous honeycomb layers, while the [Fe(CN)6]3− anions and the remainder of the water molecules form anionic sheets based on extensive hydrogen‐bonding networks. The cationic and anionic layers alternate along the c axis. The Fe atom in [Fe(CN)6]3− lies on an inversion centre and the axial cyano ligands are hydrogen bonded to the water molecules encapsulated within the micropores [N⋯O = 2.788 (5) Å], giving an unusual interpenetration between the cationic and anionic layers. On the other hand, the in‐plane cyano ligands are relatively weakly hydrogen bonded to the water molecules [N⋯O = 2.855 (7) and 2.881 (8) Å] within the anionic sheets. 相似文献
2.
John Bacsa Hanhua Zhao Kim R. Dunbar 《Acta Crystallographica. Section C, Structural Chemistry》2003,59(12):m561-m564
Two new iron–oxo clusters, viz. di‐μ‐trifluoroacetato‐μ‐oxo‐bis[(2,2′‐bipyridine‐κ2N,N′)(trifluoroacetato‐κO)iron(III)], [Fe2O(CF3CO2)4(C10H8N2)2], and bis(2,2′‐bipyridine)di‐μ3‐oxo‐hexa‐μ‐trifluoroacetato‐bis(trifluoroacetato)tetrairon(III) trifluoroacetic acid solvate, [Fe4O2(CF3CO2)8(C10H8N2)2]·CF3CO2H, contain dinuclear and tetranuclear FeIII cores, respectively. The FeIII atoms are in distorted octahedral environments in both compounds and are linked by oxide and trifluoroacetate ions. The trifluoroacetate ions are either bridging (bidentate) or coordinated to the FeIII atoms via one O atom only. The fluorinated peripheries enhance the solubility of these compounds. Formal charges for all the Fe centers were assigned by summing valences of the chemical bonds to the FeIII atom. 相似文献
3.
Yoshiki Ohgo Saburo Neya Takahisa Ikeue Noriaki Funasaki Mikio Nakamura 《Acta Crystallographica. Section C, Structural Chemistry》2001,57(9):1046-1047
The X‐ray crystallographic analysis of the title complex, chloro[3,10,13,20‐tetraethyl‐4,9,14,19‐tetramethylpentacyclo[16.2.1.12,5.18,11.112,15]tetracosa‐2,4,6,8(23),9,12,14,16,18(21),19‐decaene]iron(III) chloroform solvate, [Fe(C33H37N4)Cl]·CHCl3, reveals a twisted macrocyclic framework with a slightly distorted rectangular pyramidal core, where the deviation of the central FeIII atom from the least‐squares plane of the C20N4 core is 0.594 (1) Å. Some important bond distances are as follows: Fe—N 2.019 (3), 2.026 (3), 2.028 (3) and 2.034 (3) Å; Fe—Cl 2.232 (1) Å. 相似文献
4.
Yun‐Ling Gao Xiao‐Jun Peng Shi‐Guo Sun Chang‐Neng Chen 《Acta Crystallographica. Section C, Structural Chemistry》2005,61(1):m13-m15
The novel μ‐oxo‐diiron complex [Fe2O(BPHPA)2](ClO4)4 [BPHPA is (6‐hydroxymethyl‐2‐pyridylmethyl)bis(2‐pyridylmethyl)amine, C19H20N4O], contains a binuclear centrosymmetric [Fe2O(BPHPA)2]4+ cation (the bridging O atom lies on an inversion centre) and four perchlorate anions. Each iron ion is coordinated by four N atoms [Fe—N = 2.117 (5)–2.196 (5) Å] and one O atom [Fe—O = 2.052 (5) Å] from a BPHPA ligand, and by one bridging oxo atom [Fe—O = 1.7896 (9) Å], forming a distorted octahedron. There are hydrogen bonds between the hydroxy group and perchlorate O atoms [O—H·O = 2.654 (7) Å]. 相似文献
5.
Kazuo Yokokawa Yoshimi Yokoyama Ken Sakai 《Acta Crystallographica. Section C, Structural Chemistry》2007,63(2):m36-m41
The syntheses and crystal structures of the title Pt2II and Pt2III dimers doubly bridged with N,N‐dimethylguanidinate ligands, namely bis(μ‐N,N‐dimethylguanidinato)bis[(2,2′‐bipyridine)platinum(II)](Pt—Pt) bis(hexafluorophosphate) acetonitrile disolvate, [Pt2II(C3H8N3)2(C10H8N2)2](PF6)2·2CH3CN, (I), and guanidinium bis(μ‐N,N‐dimethylguanidinato)bis[(2,2′‐bipyridine)sulfatoplatinum(III)](Pt—Pt) bis(hexafluorophosphate) nitrate hexahydrate, (C3H10N3)[PtIII2(C3H8N3)2(SO4)2(C10H8N2)2]NO3·6H2O, (II), are reported. The oxidation of the Pt2II dimer into the Pt2III dimer results in a marked shortening of the Pt—Pt distance from 2.8512 (6) to 2.5656 (4) Å. The change is mainly compensated for by the change in the dihedral angle between the two Pt coordination planes upon oxidation, from 21.9 (2) to 16.9 (3)°. We attribute the relatively strong one‐dimensional stack of dimers achieved in the Pt2II compound in part to the strong PtII⋯C(bpy) associations (bpy is 2,2′‐bipyridine) in the crystal structure [Pt⋯C = 3.416 (10) and 3.361 (12) Å]. 相似文献
6.
Ming‐Xue Li Peng‐Tao Ma Jing‐Ping Wang 《Acta Crystallographica. Section C, Structural Chemistry》2006,62(12):m604-m606
The title compound, bis[tris(2,2′‐bipyridine)iron(II)] tetraaquatetra‐μ4‐oxo‐pentacosa‐μ2‐oxo‐undecaoxoiron(III)sodium(I)dodecatungsten(VI) dihydrate, [Fe(C10H8N2)3]2[NaFeW12O40(H2O)4]·2H2O, consists of a dodecatungstoferrate(III) framework grafted on to an [Na(H2O)4]+ cation, two complex [Fe(2,2′‐bipy)3]2+ cations (2,2′‐bipy is 2,2′‐bipyridine) and two uncoordinated water molecules per formula unit. 相似文献
7.
Solvent water tapes in two hydrates of μ‐oxo‐bis[bis(2,2′‐bipyridine‐κ2N,N′)(sulfato‐κO)iron(III)]
O. O. E. Onawumi O. O. P. Faboya O. A. Odunola T. K. Prasad M. V. Rajasekharan 《Acta Crystallographica. Section C, Structural Chemistry》2006,62(10):m480-m483
The title compound, [Fe2O(SO4)2(C10H8N2)4], crystallizes as two different hydrates, viz. 11H2O, (I), and 15H2O, (II). The complex is binuclear, in which the two FeIII atoms are coordinated in an octahedral geometry to four N atoms from the two bipyridine ligands, to one O atom from the sulfate ion and to an oxide ion on a twofold axis, which acts as a bridge between the symmetry‐related units. The Fe⋯Fe separation is 3.556 (4) Å and the Fe—O—Fe angle is 161.6 (2)° in (I); the corresponding values are 3.544 (1) Å and 165.8 (2)° in (II). In (II), one of the O atoms of the sulfate ion is disordered over two positions. In both compounds, the solvent water molecules form slightly different one‐dimensional hydrogen‐bonded networks which pass along the c axis of the unit cell. In (I), three solvent water molecules and, in (II), one solvent water molecule, are situated on the twofold axis. In both (I) and (II), the central O atom of the metal complex lies on a twofold axis. 相似文献
8.
Jaromír Marek Pavel Kopel Zdenk Trvní
ek 《Acta Crystallographica. Section C, Structural Chemistry》2003,59(12):m558-m560
In the crystal structure of the title compound, [N,N′‐bis(3‐aminopropyl)ethylenediamine‐κ4N,N′,N′′,N′′′][1,3,5‐triazine‐2,4,6(1H,3H,5H)‐trithionato(2−)‐κ2N,S]zinc(II) ethanol solvate, [Zn(C8H22N4)2(C3HN3S3)]·C2H6O, the ZnII atom is octahedrally coordinated by four N atoms [Zn—N = 2.104 (2)–2.203 (2) Å] of a tetradentate N‐donor N,N′‐bis(3‐aminopropyl)ethylenediamine (bapen) ligand and by two S and N atoms [Zn—S = 2.5700 (7) Å and Zn—N = 2.313 (2) Å] of a trithiocyanurate(2−) (ttcH2−) dianion bonded as a bidentate ligand in a cis configuration. The crystal structure of the compound is stabilized by a network of hydrogen bonds. 相似文献
9.
Yoshiki Ohgo Saburo Neya Noriaki Funasaki Mikio Nakamura 《Acta Crystallographica. Section C, Structural Chemistry》2001,57(6):694-695
The title complex, (diethyl 3,4,8,15,19,20‐hexamethyl‐21,22,23,24‐tetraazopentacyclo[16.2.1.12,5.17,11.114,17]tetracosa‐1(20),2(22),3,5,7,9,11,13(24),14,16,18‐undecaene‐9,14‐dicarboxylate‐κ4N)iodoiron(III) chloroform solvate, [Fe(C32H32N4O4)I]·CHCl3, shows an almost planar arrangement of the corrphycene moiety with a slightly distorted trapezoid pyramidal core; the FeIII atom is 0.416 (1) Å from the plane of the C20N4 system. The Fe—N distances are 2.049 (3), 2.044 (3), 2.079 (3) and 2.075 (3) Å. The solvated chloroform forms a C—H?O hydrogen bond [C?O 3.107 (10) Å] to an adjacent carbonyl O atom. This is the first X‐ray structure analysis of a corrphycenatoiron(III) derivative. 相似文献
10.
Liang Shen Hua‐Tong Wang Yi‐Jian Zhang Zhi‐Min Jin 《Acta Crystallographica. Section C, Structural Chemistry》2004,60(4):m180-m182
The bimetallic title complex, [CuFe(CN)5(C12H30N6O2)(NO)] or [Cu(L)Fe(CN)5(NO)] [where L is 1,8‐bis(2‐hydroxyethyl)‐1,3,6,8,10,13‐hexaazacyclotetradecane], has a one‐dimensional zigzag polymeric –Cu(L)–NC–Fe(NO)(CN)3–CN–Cu(L)– chain, in which the CuII and FeII centres are linked by two CN groups. In the complex, the CuII ion is coordinated by four N atoms from the L ligand [Cu—N(L) = 1.999 (2)–2.016 (2) Å] and two cyanide N atoms [Cu—N = 2.383 (2) and 2.902 (3) Å], and has an elongated octahedral geometry. The FeII centre is in a distorted octahedral environment, with Fe—N(nitroso) = 1.656 (2) Å and Fe—C(CN) = 1.938 (3)–1.948 (3) Å. The one‐dimensional zigzag chains are linked to form a three‐dimensional network via N—H⋯N and O—H⋯N hydrogen bonds. 相似文献
11.
Xue Lü Zhi‐Gang Ren Ai‐Xia Zheng Liang Zhang Jian‐Ping Lang 《Acta Crystallographica. Section C, Structural Chemistry》2011,67(7):m241-m244
Reactions of (Et4N)[Tp*WS3] [Tp* is hydridotris(3,5‐dimethylpyrazol‐1‐yl)borate] with CuSCN in MeCN in the presence of melamine afforded the title neutral dimeric cluster [Cu4W2(C15H22BN6)2(NCS)2S6(C2H3N)2] or [Tp*W(μ2‐S)2(μ3‐S)Cu(μ2‐SCN)(CuMeCN)]2, which has two butterfly‐shaped [Tp*WS3Cu2] cores bridged across a centre of inversion by two (CuSCN)− anions. The S atoms of the bridging thiocyanate ligands interact with the H atoms of the methyl groups of the Tp* units of a neighbouring dimer to form a C—H...S hydrogen‐bonded chain. The N atoms of the thiocyanate anions interact with the H atoms of the methyl groups of the Tp* units of neighbouring chains, affording a two‐dimensional hydrogen‐bonded network. 相似文献
12.
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
13.
Takumi Konno Takashi Yoshimura Masakazu Hirotsu 《Acta Crystallographica. Section C, Structural Chemistry》2001,57(5):538-539
In the title compound, [Co(C2H6NS)(C2H8N2)2](NO3)2, the CoIII atom has a slightly distorted octahedral geometry, coordinated by one 2‐aminoethanethiolate and two ethylenediamine ligands. The three five‐membered chelate rings adopt a gauche conformation with the unfavoured (lel)2(ob) form, which is ascribed to hydrogen bonds between the amine groups in the complex cation and the nitrate counter‐anions [N?O 2.900 (3)–3.378 (3) Å]. 相似文献
14.
Li‐Fang Zhang Zhong‐Hai Ni Zhi‐Min Zong Xian‐Yong Wei Chun‐Hua Ge Hui‐Zhong Kou 《Acta Crystallographica. Section C, Structural Chemistry》2005,61(12):m542-m544
In the title one‐dimensional complex, {[MnIII(C9H10NO2)2]Cl}n, the Schiff base ligand 2‐[(2‐hydroxyethyl)iminomethyl]phenolate (Hsae−) functions as both a bridging and a chelating ligand. The MnIII ion is six‐coordinated by two N and four O atoms from four different Hsae− ligands, yielding a distorted MnO4N2 octahedral environment. Each [MnIII(Hsae)2]+ cationic unit has the Mn atom on an inversion centre and each [MnIII(Hsae)2]+ cation lies about another inversion centre. The chain‐like complex is further extended into a three‐dimensional network structure through Cl⋯H—O hydrogen bonds and C—H⋯π contacts involving the Hsae− rings. 相似文献
15.
Hai‐Yan Ge Yu‐Mei Zhang Bao‐Long Li Yong Zhang 《Acta Crystallographica. Section C, Structural Chemistry》2006,62(10):m501-m503
The coordination geometry of the CdII atom in the title complex, [Cd(NCS)2(C12H12N6)2]n or [Cd(NCS)2(mbtz)2]n, where mbtz is 1,3‐bis(1,2,4‐triazol‐1‐ylmethyl)benzene, is a distorted compressed octahedron in which the CdII atom lies on an inversion centre, coordinated by four N atoms from the triazole rings of four mbtz ligands and two N atoms from two monodentate NCS− ligands. The structure is polymeric, with 24‐membered spiro‐fused rings extending along [100] and with the 24‐membered ring containing two inversion‐related mbtz molecules. 相似文献
16.
Tao Liu Bing‐Wu Wang Yi‐Hong Chen Zhe‐Ming Wang Prof. Song Gao Prof. 《无机化学与普通化学杂志》2008,634(4):778-783
Two mixed‐valent disc‐like hepta‐nuclear compounds of [FeIIFeIII6(tea)6](ClO4)2 ( 1Fe , tea = N(CH2CH2O)33?) and [MnII3MnIII4(nmdea)6(N3)6]·CH3OH ( 2Mn , nmdea = CH3N(CH2CH2O)22?) have been synthesized by the reaction of Fe(ClO4)2·6H2O with triethanolamine (H3tea) for the former and reaction of Mn(ClO4)2·6H2O with diethanolamine (H2nmdea) and NaN3 for the later, respectively. 1Fe has the cationic cluster with a planar [FeIIFeIII6] core consisting of one central FeII and six rim FeIII atoms in hexagonal arrangement. The Fe ions are linked by the oxo‐bridges from the alcohol arms in the manner of edge‐sharing of their coordination octahedra. 2Mn is a neutral cluster with a [MnII3MnIII4] core possessing one central MnII atom surrounded by six rim Mn ions, two MnII and four MnIII. The structure is similar to 1Fe but involves six terminal azido ligands, each coordinate one rim Mn ion. 1Fe showed dominant antiferromagnetic interaction within the cluster and long‐range ordering at 2.7 K. The cluster probably has a ground state of low spin of S = 5/2 or 4/2. The long‐range ordering is weak ferromagnetic, showing small hysteresis with a remnant magnetization of 0.3 Nβ and a coercive field of 40 Oe. Moreover, the isofield of lines 1Fe are far from superposition, indicating the presence of significant zero–field splitting. Ferromagnetic interactions are dominant in 2Mn . An intermediate spin ground state 25/2 is observed at low field. In high field of 50 kOe, the energetically lowest state is given by the ms = 31/2 component of the S = 31/2 multiplet due to the Zeeman effect. Despite of the large ground state, no single‐molecule magnet behavior was found above 2 K. 相似文献
17.
Xiaoming Liu Colin A. Kilner Malcolm A. Halcrow 《Acta Crystallographica. Section C, Structural Chemistry》2002,58(5):m290-m291
The title compound, [Fe2Cl4O(C7H12N2)4], contains vertex‐sharing distorted tetrahedral [FeOCl3]? and octahedral [FeOCl(HpztBu)4]+ moieties (HpztBu is 5‐tert‐butylpyrazole), linked by a bent oxo bridging ligand. The two FeIII centres are also bridged by intramolecular hydrogen bonds between the pyrazole N—H groups and the O2? and Cl? ligands. 相似文献
18.
Jn Van
o Oga vajlenov Jaromír Marek 《Acta Crystallographica. Section C, Structural Chemistry》2003,59(5):m190-m192
The title compound, K2[Cu2(NCS)2(C12H13NO3)2], consists of two K+ cations and (N‐salicylidene‐d ‐valinato)copper(II) and (N‐salicylidene‐l ‐valinato)copper(II) coordination units connected through three‐atom thiocyanate (μ‐NCS) bridges into a centrosymmetric dianion. The CuII atom adopts a square‐pyramidal coordination, with three donor atoms of the tridentate Schiff base and one N atom of the bridging ligand (μ‐NCS) in the basal plane. The axial position is occupied by the thiocyanate S atom of a symmetry‐related ligand at an apical distance of 2.9332 (10) Å. Coulombic interactions between six‐coordinated K+ ions and the heteroatoms of neighbouring dimeric anions leads to the formation of one‐dimensional chains of molecules parallel to [010]. The superposition of the normals of the pyramidal base planes in a direction close to [001] indicates possible π–π interactions between neighbouring units. 相似文献
19.
David Martínez Majid Motevalli Michael Watkinson 《Acta Crystallographica. Section C, Structural Chemistry》2002,58(4):m258-m260
The title compound, aquachloro{2,2′‐[1,2‐ethanediylbis(nitrilomethylidyne)]diphenolato‐κ4O,N,N′,O′}manganese(III),[MnCl(C16H14N2O2)(H2O)], is a neutral manganese(III) complex with a pseudo‐octahedral metal centre. The equatorial plane comprises the four donor atoms of the tetradentate Schiff base ligand [Mn—O 1.886 (4) and 1.893 (4) Å, and Mn—N 1.978 (5) and 1.982 (5) Å], with a water molecule [Mn—O 2.383 (4) Å] and a Cl? ligand [Mn—Cl 2.4680 (16) Å] completing the coordination sphere. The distorted geometry is highlighted by the marked displacement of the MnIII ion out of the least‐squares plane of the four Schiff base donor atoms by 0.165 (2) Å. These monomeric MnIII centres are then linked into a polymeric array via hydrogen bonds between the coordinated water molecule and the phenolic O‐atom donors of an adjacent MnIII centre [O—H?O 2.789 (5) and 2.881 (5) Å]. 相似文献
20.
Karel Mach Jií Kubita Ivana Císaov Petr tpni
ka 《Acta Crystallographica. Section C, Structural Chemistry》2002,58(2):m116-m118
Reacting stoichiometric amounts of 1‐(diphenylphosphino)ferrocenecarboxylic acid and [Ti(η5‐C5HMe4)2(η2‐Me3SiC[triple‐bond]CSiMe3)] produced the title carboxylatotitanocene complex, [{μ‐1κ2O,O′:2(η5)‐C5H4CO2}{2(η5)‐C5H4P(C6H5)2}{1(η5)‐C5H(CH3)4}2FeIITiIII] or [FeTi(C9H13)2(C6H4O2)(C17H14P)]. The angle subtended by the Ti/O/O′ plane, where O and O′ are the donor atoms of the κ2‐carboxylate group, and the plane of the carboxyl‐substituted ferrocene cyclopentadienyl is 24.93 (6)°. 相似文献