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1.
The title compound, 2,2′‐(3‐oxa­pentane‐1,5‐diyl­dioxy)­diphenol, crystallizes as a methanol solvate, C16H18O5·CH4O. The methanol mol­ecule, roughly perpendicular to the mean plane of the polyether molecule, is hydrogen bonded to the two polyether OH groups and to the central ether O atom. Possible C—H?π intermolecular interactions are present.  相似文献   

2.
In the title compound, [Cd(C12H8F2N3)2(C5H5N)2], the Cd atom lies on a crystallographic twofold axis in space group Iba2. The coordination geometry about the CdII ion corresponds to a rhombically distorted octahedron, with two deprotonated 1,3‐bis(2‐fluoro­phenyl)­triazenide ions, viz. FC6H4NNNC6H4F, acting as bidentate ligands (four‐electron donors). Two neutral pyridine (py) mol­ecules complete the coordination sphere in positions cis with respect to one another. The triazenide ligand is not planar (r.m.s. deviation = 0.204 Å), the dihedral angle between the phenyl rings of the terminal 2‐fluoro­phenyl substituents being 24.6 (1)°. The triazenide and pyridine Cd—N distances are 2.3757 (18)/2.3800 (19) and 2.3461 (19) Å, respectively. Intermolecular C—H⋯F interactions generate sheets of mol­ecules in the (010) plane.  相似文献   

3.
Molecules of the title compound, C12H12N6, contain both a di­imine linkage and an N—N bond, and assume a planar structure. The compound lies about an inversion centre and there are three intramolecular C—H⋯N hydrogen bonds.  相似文献   

4.
The title compound, [Cu(C27H40BN6)2]·2CH2Cl2, contains a four‐coordinate CuII ion lying on a crystallographic inversion centre, giving rise to a near‐regular square‐planar stereochemistry. There is an axial contact of 2.71 Å between the Cu ion and ligand B—H group, although this is unlikely to correspond to a significant `agostic' interaction.  相似文献   

5.
The title copper(II) complex, [Cu(C22H18N6)2](ClO4)2·2C2H3N, comprises two neutral substituted tris­(pyrazol‐1‐yl)­methane ligands bonded to a central CuII ion, which is positioned on a crystallographic inversion center. Six Cu—N bonds are arranged in a distorted octa­hedral fashion. The unsubstituted pyrazole rings on each ligand are oriented trans with respect to each other, inter­digitated with the two 3‐phenyl­pyrazole rings of the other ligand.  相似文献   

6.
The title complex, [Pd{(py)3COH}2](NO3)2, where (py)3COH is tris­(pyridin‐2‐yl)­methanol (C16H13N3O), studied at 150 and 298 K, has the potentially tridentate ligands present as bidentate ligands, with the Pd atom at a centre of symmetry. At 150 K, the Pd—N distances are 2.022 (3) and 2.026 (3) Å. The mean planes of the coordinated pyridine groups form dihedral angles of 42.1 (1) and 45.3 (1)° (at 150 K) with the coordination plane; the uncoordinated rings situated either side of the coordination plane form dihedral angles of 42.2 (1)° with it. The nitrate ions are regular and interact weakly with the hydroxyl group.  相似文献   

7.
The title compound, [Ni(BMTT)2], where BMTT is 1,3‐bis(2‐methyl­tetrazol‐5‐yl)­triazenide (C4H6N11), presents a molecular complex with tridentate ligands. The tridentate mode of the ligand is realised through the central N atom of the triazene group and two N atoms of the two tetrazole rings. The [Ni(BMTT)2] mol­ecule is the meridional isomer, with crystallographic symmetry in space group P42/n. The nickel centre has a distorted octahedral environment, with two axial Ni—N bonds of 2.041 (2) Å and four equatorial Ni—N bonds of 2.0739 (14) Å. The mol­ecules are linked together by van der Waals interactions only.  相似文献   

8.
The title compound, [CuBr(C6H7NO)2]Br·H2O, is an ionic mononuclear complex in which the [CuBr(C6H7NO)2]+ cation possesses distorted square‐pyramidal geometry. The CuII centre is coordinated by two neutral 2‐(pyridin‐2‐yl)methanol (2‐pyMeOH) ligands and a terminal bromide ligand. The 2‐pyMeOH ligands are coordinated in a bidentate chelating manner through the pyridine N and hydroxy O atoms, forming a five‐membered chelate ring with the CuII centre. The planes of the pyridine rings are twisted by 58.71 (14)° with respect to each other. The charge is balanced by a noncoordinating bromide anion which, together with a solvent water molecule, links the components through hydrogen bonds into infinite chains propagating along the a axis. The mononuclear cations appear to associate in pairs through weak interactions between the metal atom of one cation and the halogen atom of an adjacent cation.  相似文献   

9.
In the title compound, [Ni(C2H3O)2(C3H4N2)4], the Ni atom is coordinated centrosymmetrically by four N and two O atoms in an octahedral coordination [Ni—N = 1.986 (3) and 2.054 (3) Å; Ni—O = 2.697 (3) Å]. The O atoms of the acetate anions form hydrogen bonds to adjacent imidazole moieties, with the free O atom forming a somewhat shorter bond [N?O = 2.679 (3) and 2.870 (4) Å]. The hydrogen bonds give rise to a two‐dimensional layer structure.  相似文献   

10.
The title compound, [RuH(C6H8BN4)(C21H21P)2(CO)], possesses two trans‐disposed tri‐p‐tolyl­phosphines in axial positions and the remaining ligands in equatorial positions. The overall geometry of the RuII ion is a distorted octahedral structure. The P—Ru—P axis deviates from linearity by about 13°. This distortion arises mainly from the steric congestion between the bulky phosphine moieties and the tetrahedral di­hydro­bis­(pyrazol‐1‐yl)­borate ligands.  相似文献   

11.
In the centrosymmetric title complex, [Ni(C7H7N4O3)2(C5H5N)2], the coordination geometry about the Ni2+ ion is octahedral, with two deprotonated 1‐methyl‐3‐(p‐nitro­phenyl)­triazenide 1‐oxide ions, viz. [O2N­C6H4­NNN(O)­CH3]?, acting as bidentate ligands (four‐electron donors). Two neutral pyridine (py) mol­ecules complete the coordination sphere in positions trans to each other. The triazenide 1‐oxide ligand is almost planar, the largest interplanar angle of 8.80 (12)° being between the phenyl ring of the p‐nitro­phenyl group and the plane defined by the N3O moiety. The Ni—Ntriazenide, Ni—O and Ni—Npy distances are 2.0794 (16), 2.0427 (13) and 2.1652 (18) Å, respectively.  相似文献   

12.
The asymmetric unit of the title compound, [Ni(C11H16ClN5)2]Cl2·C3H7NO, contains one monomeric nickel(II) com­plex cation, two Cl anions and one di­methyl­form­amide sol­vent mol­ecule. The Ni atom is coordinated to each of two 1‐­(p‐chloro­phenyl)‐5‐iso­propyl­biguanide (proguanil) ligands via two N atoms. The complex exhibits a square‐planar coordination, with the Ni atom lying 0.021 (2) Å out of the basal plane. The crystal packing is characterized by several hydrogen bonds.  相似文献   

13.
In the mononuclear title compound, [ZnCl2(C14H13NO)2], the ZnII ion is located on a twofold axis of the monoclinic space group so that the whole mol­ecule has a twofold symmetry. The ZnII ion has a tetrahedral coordination consisting of two chlorine ions and the O atoms of the ligands. The coordination angles around zinc have values between 102.89 (8) (O—Zn—O) and 115.83 (5)° (Cl—Zn—O). The Zn—O and Zn—Cl bond lengths are 1.977 (2) and 2.2401 (7) Å, respectively. There are intra‐ and intermolecular hydrogen bonds in the structure.  相似文献   

14.
The crystal structure of the title compound, [Ni(NCS)2(C4H12N2O)2], has two crystallographically independent half‐mol­ecules in the asymmetric unit, with each Ni atom residing on a centre of symmetry. The two mol­ecules exhibit similar coordination geometry but display differences with regard to other structural features. Each NiII centre is octahedrally coordinated by two mutually trans chelating hydroxy­ethyl­ethyl­ene­di­amine ligands and two mutually trans iso­thio­cyanate ions. The two independent mol­ecules form chains through different types of non‐covalent interactions. In the case of one of the mol­ecules, only NCS and free OH groups participate in hydrogen bonding, while in the chain based on the second mol­ecule, the NCS, NH, NH2 and free OH groups are involved in intermolecular hydrogen bonding. The two chains interact with one another through hydrogen bonding, forming planar sheets. The third packing direction is mediated only by van der Waals interactions.  相似文献   

15.
The title compound, [Cu2(C14H23N5)2(CH3O)2](PF6)2, has a doubly methoxo‐bridged centrosymmetric copper dimer cation involving two tridentate bis­(pyrazolyl)­amine ligands. The geometry of each CuII atom is a distorted square pyramid with two N atoms of the pyrazole in bis­[2‐(3,5‐di­methyl‐1‐pyrazolyl)­ethyl]­amine (bpea) and two μ2‐bridging O atoms of the methoxo ligands forming the basal plane, and the amine N atom occupying the axial position. In the bridging plane, the Cu—O bond lengths are 1.940 (4) and 1.942 (4) Å, and the bond angles for O—Cu—O and Cu—O—Cu are 76.1 (2) and 103.9 (2)°, respectively. The Cu?Cu distance is 3.058 (1) Å. The central four‐membered ring lies on an inversion centre.  相似文献   

16.
The title compound, [Cu2(C8H6N3)2(C2H3N)2](ClO4)2, con­tains a centrosymmetric dinuclear dication, with square‐pyrami­dal CuII centres linked by two 1,2‐pyrazolide bridging groups. There is a weak apical interaction between each Cu ion and a perchlorate O atom.  相似文献   

17.
In the crystal structure of [Cu(CF3SO3)(C2N3)(C8H7N5)2]·0.5C2H6O, the CuII atom adopts a distorted octahedral geometry, with the basal plane formed by two N atoms of one dipyrimidinyl­amine ligand, one N atom of the second pyrimidine ligand and a nitrile N atom of the dicyan­amide anion [Cu—N = 1.972 (2)–2.021 (2) Å]. The apical positions are occupied by an N atom of the second ligand [Cu—N = 2.208 (2) Å], and an O atom of the tri­fluoro­methane­sulfonate anion [Cu—O = 2.747 (2) Å] at a semi‐coordination distance. Pairs of inversion‐related N—H⋯N hydrogen bonds of the so‐called Watson–Crick type, augmented by two C—H⋯N contacts, link adjacent complexes into an infinite one‐dimensional chain running in the [101] direction.  相似文献   

18.
The title compounds, [Cu(C15H12Cl2NO)2], (I), and [Cu(C17­H18NO2)2], (II), both adopt a compressed tetrahedral trans‐[CuN2O2] coordination geometry, the mol­ecules having an umbrella conformation overall. These complexes differ from one another with respect to the 1‐phenyl­ethyl­amine moieties, the direction of the benzene rings being either inside [in (I)] or inside and outside [in (II)] of the mol­ecules. The crystals of (I) and (II) have Δ(R,R) and Λ(R,R) absolute configurations, respectively.  相似文献   

19.
The title compound, [Cu(C4H12N2)2(C3H6O)2](ClO4)2, is the first structurally characterized CuII complex having acetone as axial ligands. The complex adopts an elongated octahedral trans‐[CuN4O2] coordination geometry, with the Cu atom having 222 site symmetry. The axial Cu—O(acetone) and in‐plane Cu—N bond lengths are 2.507 (5) and 2.041 (3) Å, respectively.  相似文献   

20.
The title compound, [Cu(ClO4)2(C4H9N3O2)2][Cu(C4H9N3O2)2(CH4O)2](ClO4)2·2CH3OH, comprises two independent CuII species lying on different inversion sites. In the Cu complexes, a distorted octa­hedral geometry arises (from basic square‐planar N4 coordination) from the weak coordination of two perchlorate ions (as Cu—O) in one species and two methanol mol­ecules in the other (also as Cu—O). Inter­actions between the O atoms of the perchlorate anions or methanol groups and the imide or amine NH groups afford an extensive inter­molecular hydrogen‐bonding network.  相似文献   

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