Browse
Submit Data
Databases
API
Help

Dataset Information

0 Views

0 Connections

0 Citations

0 Reanalyses

0 Downloads

Omics score: 0

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

ABSTRACT: 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.

SUBMITTER: Tan MX

PROVIDER: S-EPMC2961003 | biostudies-literature | 2008 Mar

REPOSITORIES: biostudies-literature

ACCESS DATA

Json Xml

Publications

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

Tan Ming-Xiong MX Chen Zhen-Feng ZF Neng Zhou Z Liang Hong H

Acta crystallographica. Section E, Structure reports online 20080329 Pt 4

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 ...[more]

PMID: 21202044

Similar Datasets

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

Project description: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.

| S-EPMC2960937 | 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

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

{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

(2E)-N-(3,5-Dibromo-4-methoxy-phen-yl)-2-(hydroxy-imino)acetamide.

Project description:The title compound, C(9)H(8)Br(2)N(2)O(3), is planar (r.m.s. deviation = 0.030?Å) with the exception of the terminal methyl group which lies out of the plane [1.219?(3)?Å]. The conformation about the C=N double bond [1.268?(3)?Å] is E. An intra-molecular N-H?N hydrogen bond occurs. Linear supra-molecular chains along the b axis mediated by O-H?O hydrogen-bonding inter-actions feature in the crystal structure. These chains are also stabilized by weak C-H?N contacts.

| S-EPMC2979508 | biostudies-literature

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

Project description:The title compound, C(7)H(4)Br(2)O(2), exhibits a layer packing structure via weak π-π stacking inter-actions [centroid-centroid distances between adjacent aromatic rings are 4.040 (8) and 3.776 (7) Å]. Mol-ecules in each layer are linked by inter-molecular O-H⋯O hydrogen bonding and Br⋯Br inter-actions [3.772 (4) Å]. There are two mol-ecules in the asymmetric unit.

| S-EPMC2961300 | biostudies-literature

Tetra-kis[?-2-(3-phenoxy-phen-yl)propionato-?O:O']bis-[(dimethyl-formamide-?O)copper(II)].

Project description:The title compound, [Cu(2)(C(15)H(13)O(3))(4)(C(3)H(7)NO)(2)], is formed by the chelate coordination of four racemic fenoprofenate (fenoprofenate is 2,3-phenoxyphenyl propionate) anions and two dimethyl-formamide mol-ecules to two copper(II) ions, building a paddle-wheel dinuclear mol-ecule. The distorted square-pyramidal coordination of each Cu(II) atom is made up of four O atoms of the four fenoprofenate units and another O atom from a dimethyl-formamide mol-ecule. The two enanti-omeric forms of the fenoprofenate anions are present in the complex, in an optically inactive centrosymmetric arrangement.

| S-EPMC2959860 | biostudies-other

(3,5-Dichloro-salicylaldehyde thio-semi-carbazonato-κS,N,O)(N,N'-dimethyl-formamide-κO)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-literature

2,4-Dibromo-6-[(E)-({3-[(E)-(3,5-dibromo-2-oxidobenzyl-idene)aza-nium-yl]-2,2-dimethyl-prop-yl}iminium-yl)meth-yl]phenolate.

Project description:In the title mol-ecule, C(19)H(18)Br(4)N(2)O(2), the dihedral angle between the benzene rings is 73.9?(2)°. Two intra-molecular N-H?O hydrogen bonds make S(6) ring motifs. In the crystal, mol-ecules are linked via C-H?O inter-actions, forming chains propagating along the a-axis directon. A short C?Br [3.401?(5)?Å] contact is present in the crystal structure, which is further stabilized by a ?-? inter-action [centroid-centroid distance = 3.739?(3)?Å].

| S-EPMC3275012 | biostudies-literature

3,11-Dibromo-14-(4-chloro-phen-yl)-14H-dibenzo[a,j]xanthene dimethyl-formamide monosolvate.

Project description:In the title compound, C(27)H(15)Br(2)ClO·C(3)H(7)NO, the xanthene moiety has a flattened boat conformation with a folding angle between the naphthalene units of 9.46 (3)°. The mean planes of the xanthene system and its 4-chloro-phenyl substituent are nearly perpendicular [dihedral angle = 89.43 (5)°]. The dimethyl-formamide solvent mol-ecule is disordered over two sets of sites with an occupancy ratio of 0.520 (11):0.480 (11).

| S-EPMC3344574 | 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