Browse
Submit Data
Databases
API
Help

Dataset Information

11 Views

0 Connections

0 Citations

0 Reanalyses

0 Downloads

Omics score: 0

[(2S)-2-(3,5-Dichloro-2-oxidobenzyl-ideneamino)-3-(4-hydroxy-phen-yl)propionato-κO,N,O'](dimethyl-formamide-κO)copper(II).

ABSTRACT: In the title complex, [Cu(C(16)H(11)Cl(2)NO(4))(C(3)H(7)NO)] , the Cu(II) atom is coordinated by two O atoms and one N atom from the tridentate ligand L(2-) {LH(2) = (2S)-[2-(3,5-dichloro-2-hydroxy-benzyl-idene)-imino]-3-(4-hydroxy-phenyl)propionic acid} and one O atom from a dimethyl-formamide mol-ecule, resulting in a slightly distorted square-planar geometry. The structure forms a one-dimensional chain through weak coordination bonds [Cu⋯O 3.080 (1), Cu⋯Cl 3.269 (1) Å] and a three-dimensional network through O-H⋯O and C-H⋯O hydrogen bonds.

SUBMITTER: Tan MX

PROVIDER: S-EPMC2960937 | biostudies-literature |

REPOSITORIES: biostudies-literature

ACCESS DATA

Json Xml

Similar Datasets

[(E)-2-(3,5-Dibromo-2-oxidobenzyl-ideneamino)-3-(4-hydroxy-phen-yl)propionato-?O,N,O'](dimethyl-formamide-?O)copper(II).

Project description:In the title complex, [Cu(C(16)H(11)Br(2)NO(4))(C(3)H(7)NO)](2), there are two unique mol-ecules in the asymmetric unit. Each Cu(II) atom is coordinated by two O atoms and one N atom from the tridentate ligand L(2-) [LH(2) = (E)-2-(3,5-dibromo-2-hydroxy-benzyl-idene-amino)-2-(4-hydroxy-phenyl)acetic acid] and the O atom of a dimethyl-formamide mol-ecule to give a slightly distorted square-planar geometry. The two unique mol-ecules form a dimer through weak C-H?O hydrogen bonds. In the dimer, the Cu?Cu distance is 3.712?(1)?Å. In the crystal structure, mol-ecules form a one-dimensional chain through C-H?O hydrogen bonds. These are further aggregated into a three-dimensional network by O-H?O and C-H?O hydrogen bonds.

| S-EPMC2961003 | biostudies-literature

{2-[(3,5-Dichloro-2-oxidobenzyl-idene)amino-κN,O]-3-methyl-penta-noato-κO}(N,N'-dimethyl-formamide-κO)copper(II).

Project description:In the title compound, [Cu(C(13)H(13)Cl(2)NO(3))(C(3)H(7)NO)], the Cu(II) atom is coordinated in a slightly distorted square-planar geometry by two O atoms and one N atom from the tridentate chiral ligand 2-[(3,5-dichloro-2-oxidobenzyl-idene)amino]-3-methyl-penta-noate and by one O atom from dimethyl-formamide. In the crystal structure, the Cu atom forms contacts with Cl and O atoms of two units (Cu⋯Cl and Cu⋯O = 3.401 and 2.947 Å, respectively), thereby forming an approximately octa-hedral arrangement. A three-dimensional network is constructed through Cl⋯Cu, O⋯Cu, Cl⋯Cl contacts and C-H⋯O hydrogen bonds.

| S-EPMC2961092 | biostudies-literature

Aqua-{2-[(3,5-dichloro-2-oxidobenzyl-idene)amino]-3-(4-hydroxy-phen-yl)propionato-?O,N,O}copper(II) sesquihydrate.

Project description:In the title compound, [Cu(C(16)H(11)Cl(2)NO(4))(H(2)O)]·1.5H(2)O, the Cu(II) atom is coordinated by two O atoms and one N atom from the 2-[(3,5-dichloro-2-oxidobenzyl-idene)amino]-3-(4-hydroxy-phen-yl)propionate ligand, and by the O atom from a water mol-ecule in a square-planar coordination. There are two formula units in the asymmetric unit. Molecules are further assembled into a three-dimensional network through C-H?Cl contacts, a Cu?Cl weak inter-action [3.161?(2)?Å], O-H?O and C-H?O hydrogen bonds. The three water mol-ecules of the asymmetric unit are distributed over five positions with one full and two approximately half occupancies, while a tyrosine side chain in one of the complex mol-ecules is disordered over two positions [occupancies 0.507?(5) and 0.493?(5)].

| S-EPMC2961633 | biostudies-literature

cis-Aqua-bis(2,4-dichloro-6-formyl-phenolato-κO,O')(N,N-dimethyl-formamide-κO)nickel(II).

Project description:In the title compound, [Ni(C(7)H(3)Cl(2)O(2))(2)(C(3)H(7)NO)(H(2)O)], the Ni(II) ion is coordinated by four O atoms from two bidentate 2,4-dichloro-6-formyl-phenolate ligands, one O atom from a water ligand and one O atom from a dimethyl-formamide ligand in a slightly distorted octa-hedral environment. In the crystal structure, centrosymmetric dimers are formed though O-H⋯O and O-H⋯Cl hydrogen bonds; π-π stacking inter-actions, with a centroid-centroid distance of 3.796 (2) Å, are also found.

| S-EPMC2961979 | biostudies-literature

?-4,4'-Bipyridine-?N:N'-bis-{[2-(3,5-dibromo-2-oxidobenzyl-ideneamino)-3-hydroxy-propanoato-?O,N,O']copper(II)} monohydrate.

Project description:The title compound, [Cu(2)(C(10)H(7)Br(2)NO(4))(2)(C(10)H(8)N(2))]·H(2)O, is a binuclear copper(II) complex. Both Cu atoms are four-coordinate in a square-planar geometry. In addition, there is one water mol-ecule in the asymmetric unit. The crystal structure is stabilized by O-H?O and O-H?Br hydrogen bonds.

| S-EPMC2961693 | biostudies-literature

3,5-Dichloro-2-hydroxy-benzaldehyde.

Project description:The title compound, C(7)H(4)Cl(2)O(2), exhibits a layer crystal structure; mol-ecules within each layer are linked by weak C-H?O inter-molecular hydrogen bonds. There is also an intramolecular O-H?O hydrogen bond.

| S-EPMC2961496 | biostudies-literature

catena-Poly[[[bis-[μ-3-(4-carb-oxy-phen-oxy)propionato]-κO,O:O;κO:O,O-bis-[aqua-(N,N-dimethyl-formamide-κO)cadmium]]-μ-4,4'-bipyridine-κN:N'] dinitrate].

Project description:In the title coordination polymer, {[Cd(2)(C(10)H(9)O(5))(2)(C(10)H(8)N(2))(2)(C(3)H(7)NO)(2)(H(2)O)(2)](NO(3))(2)}(n), the 3-(4-carb-oxy-phen-oxy)propionate monoanion O,O'-chelates to a Cd(II) cation through the aliphatic carboxyl-ate end. One of these O atoms is also connected to the metal cation from an inversion-related metal atom. The five O atoms bonded to the metal centre form a penta-gon, above and below which are located the N atoms of the 4,4'-bipyridine mol-ecules. The polycationic ribbon propagates along the b axis of the unit cell. The (aromatic) carboxyl end of the monoanion connects adjacent ribbons into a layer motif in the (102) plane. The nitrate ions are hydrogen bonded to the layer. The geometry of the Cd(II) atom is a trans-N(2)O(5)Cd penta-gonal bipyramid.

| S-EPMC3274930 | biostudies-literature

(3,5-Dichloro-salicylaldehyde thio-semi-carbazonato-?S,N,O)(N,N'-dimethyl-formamide-?O)copper(II) dimethyl-formamide solvate.

Project description:In the title compound, [Cu(C(8)H(5)Cl(2)N(3)OS)(C(3)H(7)NO)]·C(3)H(7)NO, the Cu(II) atom is coordinated in a slightly distorted square-planar geometry by an O, an S and an N atom from the tridentate ligand 3,5-dichloro-salicylaldehyde thio-semi-carb-azonate ligand and one O atom from dimethyl-formamide. At the same time, the Cu atom is in contact with S and Cl atoms from another two complexes [Cu?S and Cu?Cl = 2.9791?(2) and 3.3800?(3)?Å, respectively], thereby forming a [4 + 2] coordination geometry. The crystal structure exhibits N-H?O and N-H?N hydrogen bonds.

| S-EPMC2961129 | biostudies-other

2,2-Dichloro-N-(3,5-dimethyl-phen-yl)-acetamide.

Project description:The structure of the title compound, C(10)H(11)Cl(2)NO, resembles those of 2,2-dichloro-N-phenyl-acetamide, 2,2-dichloro-N-(2-methyl-phen-yl)acetamide, 2,2-dichloro-N-(3-methyl-phen-yl)-acetamide, 2,2-dichloro-N-(4-methyl-phen-yl)acetamide, N-(3,5-dimethyl-phen-yl)acetamide and other acetanilides, with similar bond parameters. The mol-ecules in the title compound are linked into infinite chains through N-H?O and C-H?O hydrogen bonding.

| S-EPMC2915270 | biostudies-literature

N-(3,5-Dichloro-phen-yl)-2,4-dimethyl-benzene-sulfonamide.

Project description:In the crystal structure of the title compound, C(14)H(13)Cl(2)NO(2)S, the conformation of the N-C bond in the C-SO(2)-NH-C segment has gauche torsions with respect to the S=O bonds. The mol-ecule is bent at the N atom, with an C-SO(2)-NH-C torsion angle of -54.9?(3)°. The two benzene rings are tilted relative to each other by 82.3?(2)°. The mol-ecules are linked into centrosymmetric R(2) (2)(8) motifs by N-H?O hydrogen bonds and C-H?? inter-actions along [100].

| S-EPMC2979206 | biostudies-literature

OmicsDI is part of the ELIXIR infrastructure

OmicsDI is an Elixir interoperability service. Learn more ›

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