Browse
Submit Data
Databases
API
Help

Dataset Information

21 Views

0 Connections

0 Citations

0 Reanalyses

0 Downloads

Omics score: 0

Bis{μ-1-[(2-ethyl-1H-imidazol-1-yl)meth-yl]-1H-benzotriazole}bis-(iodido-cadmium).

ABSTRACT: The dinuclear title complex, [Cd(2)I(4)(C(12)H(13)N(5))(2)], lies on a crystallographic center of inversion. The Cd(II) atom is four-coordinated by two N atoms from two 1-[(2-ethyl-1H-imidazol-1-yl)meth-yl]-1H-benzotriazole (bmei) ligands and two terminal I atoms in a distorted tetra-hedral coordination environment. The Cd(II) atoms are connected to each other by two bridging bmei ligands. The benzotriazole rings in adjacent mol-ecules are almost parallel, with an average inter-planar distance of 3.3400 (2) Å and a centroid-centroid distance of 4.852 (2) Å.

SUBMITTER: Wang X

PROVIDER: S-EPMC3152091 | biostudies-literature |

REPOSITORIES: biostudies-literature

ACCESS DATA

Json Xml

Similar Datasets

catena-Poly[[chloridocadmium(II)]bis-{μ-1-[(2-ethyl-1H-imidazol-1-yl)meth-yl]-1H-benzotriazole}[chloridocadmium(II)]di-μ-chlorido].

Project description:In the polymeric title complex, [CdCl(2)(C(12)H(13)N(5))](n), the Cd(II) atom is five-coordinated by two N atoms from two bridging 1-[(2-ethyl-1H-imidazol-1-yl)meth-yl]-1H-benzotriazole (bmei) ligands, two bridging Cl atoms and one terminal Cl atom in a distorted trigonal-bipyramidal geometry. The Cd(II) atoms are connected alternately by the Cl atoms and bmei ligands, leading to a zigzag chain extending parallel to [011]. π-π inter-actions, with a centroid-centroid distance of 3.3016 (3) Å, help to stabilize the crystal packing.

| S-EPMC3151992 | biostudies-literature

Bis(μ-1,2-bis-{[2-(2-pyrid-yl)-1H-imidazol-1-yl]meth-yl}benzene)bis-[bis-(thio-cyanato-κN)cadmium(II)].

Project description:The asymmetric unit of the binuclear title compound, [Cd(2)(NCS)(4)(C(24)H(20)N(6))(2)], contains one half-mol-ecule, consisting of one Cd(2+) cation, two half 1,2-bis-{[2-(2-pyrid-yl)-1H-imidazol-1-yl]meth-yl}benzene (L) ligands and two SCN(-) anions. The dimeric cyclic mol-ecule is completed by crystallographic inversion symmetry. The Cd(2+) cation is coordinated by two N atoms from two SCN(-) anions and four N atoms from two symmetry-related L ligands, exhibiting a distorted octrahedral coordination. A two-dimensional supra-molecular network stacked parallel to [210] is finally formed by linking these dimers through weak π-π stacking inter-actions between the pyridine rings and benzene rings of adjacent dimers, with a plane-to-plane distance of 3.36 (6) Å and a centroid-centroid distance of 3.67 (2) Å. One of the thio-cyanate S atoms is equally disordered over two positions.

| S-EPMC2983974 | biostudies-literature

catena-Poly[copper(I)-bis-[μ-3-(1H-imidazol-2-yl)pyridine]-copper(I)-di-μ-iodido].

Project description:The title polymeric compound, [Cu(2)I(2)(C(8)H(7)N(3))(2)](n) [C(8)H(7)N(3) = 3-(1H-imidazol-2-yl)pyridine (HIPy), where HIPy comes from the in situ deca-rboxylation of 2-(pyridin-3-yl)-1H-imidazole-4,5-dicarb-oxy-lic acid (H(3)PyIDC)], was obtained under solvo-thermal conditions. Each Cu(I) cation is in a distorted tetra-hedral coordination environment defined by two iodide anions and two nitro-gen atoms from two individual HIPy ligands. Two Cu(I) atoms are connected by two HIPy ligands to form a dimer and these dimers are further bridged through the iodide atoms, leading to a chain structure extending parallel to [100]. Moreover, inter-molecular N-H⋯I hydrogen bonds and weak π-π stacking inter-actions [centroid⋯centroid distances of 3.809 (4) Å, an inter-planar separation of 3.345 (3) Å and a ring slippage of 1.822 Å] between pyridyl rings link the chains into a two-dimensional supra-molecular network in the ac plane.

| S-EPMC3200664 | biostudies-literature

Bis{μ-2,4-di-tert-butyl-6-[3-(1H-imidazol-1-yl)propyl-imino-meth-yl]phenolato}bis-[acetatocopper(II)].

Project description:In the centrosymmetric title compound, [Cu(2)(C(21)H(30)N(3)O)(2)(C(2)H(3)O(2))(2)], each Cu atom has a distorted tetra-hedral coordination geometry defined by N and O atoms in a chelate ring, N of an imidazole ring, and an acetate O atom. The uncoordinated acetate O atom is disordered over two sites with occupancies 0.7:0.3.

| S-EPMC2914935 | biostudies-literature

catena-Poly[[aqua-[1,4-bis-(1H-imidazol-4-yl)benzene]cadmium]-μ(3)-5-methyl-isophthalato].

Project description:In the title coordination polymer, [Cd(C(9)H(6)O(4))(C(12)H(10)N(4))(H(2)O)](n), the Cd(II) atom has a NO(6) donor set and is coord-inated by five carboxyl-ate O atoms from three different 5-methyl-1,3-phenyl-enediacetate (pda(2-)) anions, one O atom from a water mol-ecule and one N atom from a 1,4-bis-(1H-imidazol-4-yl)benzene (L) ligand, displaying a highly distorted penta-gonal-bipyramidal geometry. Each pda(2-) anion acts as a μ(3)-bridge, linking Cd(II) atoms to form one-dimensional slabs extending parallel to [010]. In the crystal, adjacent mol-ecules are linked through N-H⋯N and N-H⋯O hydrogen bonds into a three-dimensional network.

| S-EPMC3200974 | biostudies-literature

9-Ethyl-3,6-bis-(1H-imidazol-1-yl)-9H-carbazole.

Project description:In the crystal structure of the title compound, C(20)H(17)N(5), the two imidazole rings are twisted with respect to the carbazole plane, making dihedral angles of 55.8?(2) and 43.7?(2)°. The crystal structure is stabilized by weak C-H?N and C-H?? inter-actions.

| S-EPMC2961443 | biostudies-literature

5,5'-Bis[(1H-imidazol-1-yl)meth-yl]-2,2'-bipyridine methanol disolvate.

Project description:The title compound, C(18)H(16)N(6)·2CH(3)OH, was prepared by the reaction of 5,5'-bis-(bromo-meth-yl)-2,2'-bipyridine with imidazole. The main mol-ecule lies on an inversion center located at the mid-point of the C-C bond joining the two pyridine rings. The asymmetric unit therefore contains one half-mol-ecule and one methanol solvent mol-ecule. The dihedral angle between the pyridine and imidazole rings is 72.32 (5)°. In the crystal, weak inter-molecular O-H⋯N, C-H⋯N and C-H⋯O hydrogen bonds contribute to the stabilization of the packing.

| S-EPMC3051999 | biostudies-literature

N,N'-Bis[(1H-imidazol-1-yl)meth-yl]-2,2'-(disulfanedi-yl)dianiline.

Project description:The symmetrical title compound, C(20)H(20)N(6)S(2), contains a disulfide bond of 2.0884?(6)?Å. The C-S-S-C torsion angle is -59.57?(7)°. In the crystal, classical N-H?N and non-classical C-H?N hydrogen bonds link the compounds into chains along the a axis.

| S-EPMC3393319 | biostudies-literature

Crystal structure of di-μ-iodido-bis-{[1,3-bis-(2,6-diiso-propyl-phen-yl)imidazol-2-yl-idene]lithium}.

Project description:In the title binuclear complex, [Li2(C27H36N2)2I2], the unique Li(I) cation is coordinated by two iodide anions and one yl-idene C atom from a 1,3-bis-(2,6-diiso-propyl-phen-yl)imidazol-2-yl-idene ligand in a distorted trigonal-planar geometry. The two symmetry-related iodide anions bridge two Li(I) cations, forming an inversion dimer in which the Li2I2 plane is nearly perpendicular to the imidazol-2-yl-idene ring, with a dihedral angle of 85.5 (3)°. No hydrogen bonding is observed in the crystal.

| S-EPMC4459370 | biostudies-literature

Diaqua-bis-[4-(1H-imidazol-2-yl)pyridine-?N]bis-(nitrato-?O)cadmium.

Project description:In the title compound, [Cd(NO3)2(C8H7N3)2(H2O)2], the Cd(II) cation is situated on an inversion center and is coordinated by the O atoms of two nitrate anions, by the N atoms of two 4-(imidazol-2-yl)pyridine ligands and by two water O atoms in a slightly distorted N2O4 octa-hedral geometry. The dihedral angle between the imidazole and pyridine rings is 1.6?(2)°. In the crystal, mol-ecules are linked by N-H?O, O-H?N and O-H?O hydrogen bonds, forming a three-dimensional network.

| S-EPMC3588280 | biostudies-literature

OmicsDI is part of the ELIXIR infrastructure

OmicsDI is an Elixir interoperability service. Learn more ›

Tweets

OmicsDI Databases

PRIDE
PeptideAtlas
MassIVE
JPOST Repository
Physiome Model Repository

EGA
EVA
ENA
LINCS
PAXDB
Cell Collective

MetaboLights
Metabolomics Workbench
MetabolomeExpress
GNPS
BioModels
FAIRDOMHub

ArrayExpress
dbGaP
ExpressionAtlas
GEO
NODE

Information

Databases
Help
API
Contact us
Code on GitHub
Terms of use
Submit Data