Browse
Submit Data
Databases
API
Help

Dataset Information

21 Views

0 Connections

0 Citations

0 Reanalyses

0 Downloads

Omics score: 0

1,5-Bis[1-(4-bromo-phen-yl)ethyl-idene]thio-carbonohydrazide.

ABSTRACT: The asymmetric unit of the title compound, C17H16Br2N4S, contains two independent mol-ecules in which the benzene rings form dihedral angles of 20.0?(1) and 55.3?(1)°. In the crystal, a pair of N-H?S hydrogen bonds link the two different independent mol-ecules into a dimer.

SUBMITTER: Gao Z

PROVIDER: S-EPMC3648255 | biostudies-literature | 2013 May

REPOSITORIES: biostudies-literature

ACCESS DATA

Json Xml

Publications

1,5-Bis[1-(4-bromo-phen-yl)ethyl-idene]thio-carbonohydrazide.

Gao Zhiqing Z

Acta crystallographica. Section E, Structure reports online 20130413 Pt 5

The asymmetric unit of the title compound, C17H16Br2N4S, contains two independent mol-ecules in which the benzene rings form dihedral angles of 20.0 (1) and 55.3 (1)°. In the crystal, a pair of N-H⋯S hydrogen bonds link the two different independent mol-ecules into a dimer. ...[more]

PMID: 23723875

Similar Datasets

1,5-Bis[1-(4-meth-oxy-phen-yl)ethyl-idene]thio-carbonohydrazide.

Project description:In the title mol-ecule, C(19)H(22)N(4)O(2)S, the two benzene rings form a dihedral angle of 9.16?(13)°. In the crystal, pairs of weak inter-molecular C-H?S hydrogen bonds link the mol-ecules into centrosymmetric dimers, which are further linked through weak C-H?O inter-actions into sheets parallel to (012).

| S-EPMC3213572 | biostudies-literature

1,5-Bis[1-(2,4-dihy-droxy-phen-yl)ethyl-idene]carbonohydrazide dimethyl-formamide disolvate.

Project description:In the title compound, C(17)H(18)N(4)O(5)·2C(3)H(7)NO, two solvent mol-ecules are linked to the main mol-ecule via N-H?O and O-H?O hydrogen bonds, forming a hydrogen-bonded trimer. Intra-molecular O-H?N hydrogen bonds influence the mol-ecular conformation of the main mol-ecule, and the two benzene rings form a dihedral angle of 10.55?(18)°. In the crystal, inter-molecular O-H?O hydrogen bonds link hydrogen-bonded trimers into ribbons extending along the b axis.

| S-EPMC3009339 | biostudies-literature

1,5-Bis[(E)-1-(2-hydroxy-phen-yl)ethyl-idene]carbonohydrazide dimethyl sulfoxide solvate.

Project description:The title dimethyl sulfoxide (DMSO) solvate, C(17)H(18)N(4)O(3)·C(2)H(6)OS, shows the disubstituted urea derivative to adopt an almost planar geometry (r.m.s. deviation for non-H atoms = 0.132?Å); the mol-ecule has non-crystallographic twofold mol-ecular symmetry. This conformation is stabilized by two intra-molecular O-H?N hydrogen bonds. The components of the crystal are connected by N-H?O hydrogen bonds, whereby both amine H atoms are connected to a DMSO O atom, and C-H?O contacts involving the DMSO H and urea carbonyl atoms, forming a supra-molecular chain along the c axis. The chains associate via C-H?? inter-actions.

| S-EPMC2971043 | biostudies-literature

1,5-Bis(1-phenyl-ethyl-idene)carbonohydrazide.

Project description:In the title mol-ecule, C(17)H(18)N(4)O, the two phenyl rings form a dihedral angle of 18.15?(17)°. In the crystal, pairs of inter-molecular N-H?O hydrogen bonds link the mol-ecules into centrosymmetric dimers. Weak inter-molecular C-H?O inter-actions further link the dimers into chains running along [010].

| S-EPMC3009061 | biostudies-literature

1,5-Bis(2-oxoindolin-3-yl-idene)thio-carbonohydrazide tetra-hydro-furan monosolvate.

Project description:In the thio-carbonohydrazide mol-ecule of the title compound, C(17)H(12)N(6)O(2)S·C(4)H(8)O, the terminal indolin-2-one ring systems make a dihedral angle of 20.13?(6)° with each other. Two intra-molecular N-H?O hydrogen bonds are present, each of which generates an S(6) ring. In the crystal, N-H?O hydrogen bonds lead to a mol-ecular chain running along the b axis. The tetra-hydro-furan solvent mol-ecule is disordered over two orientations in a 0.561?(11):0.439?(11) ratio.

| S-EPMC3379434 | biostudies-literature

1,5-Bis(4-iso-propyl-benzyl-idene)thio-carbonohydrazide.

Project description:The title compound, C21H26N4S, was synthesized by the condensation reaction of 4-iso-propyl-benzaldehyde with thio-carbohydrazide in ethanol. The planes of the two benzene rings in the mol-ecule are inclined at 22.6?(1)°. In the crystal, pairs of inter-molecular N-H?S hydrogen bonds link the mol-ecules into inversion dimers.

| S-EPMC3884323 | biostudies-literature

1,5-Bis-[1-(2-hy-droxy-phen-yl)ethyl-idene]carbonohydrazide dimethyl-formamide monosolvate.

Project description:In the title compound, C(17)H(18)N(4)O(3)·C(3)H(7)NO, the main disubstituted urea and solvate mol-ecules are linked by pairs of N-H?O hydrogen bonds. In the main mol-ecules, the benzene rings form a dihedral angle of 15.59?(13)° a;nd two intra-molecular O-H?N hydrogen bonds influence the mol-ecular conformation. In the crystal structure, weak inter-molecular C-H?O inter-actions link the hydrogen-bonded pairs into chains along the b axis. The chains associate via C-H?? inter-actions.

| S-EPMC2983342 | biostudies-other

1,5-Bis(2-meth-oxy-benzyl-idene)thio-carbonohydrazide methanol monosolvate.

Project description:The title compound, C17H18N4O2S·CH3OH, was synthesized by the condensation reaction of o-meth-oxy-benzaldehyde with thio-carbohydrazide in methanol. The two benzene rings are inclined each to other at 31.7?(1)°. Inter-molecular N-H?O and bifurcated O-H?N(S) hydrogen bonds link two thio-carbonohydrazide and two solvent mol-ecules into a centrosymmetric unit. These units, related by translation along the b axis, are further aggregated into columns through N-H?S hydrogen bonds.

| S-EPMC3770410 | biostudies-literature

1,5-Bis(4-meth-oxy-benzyl-idene)thio-carbonohydrazide methanol monosolvate.

Project description:In the title compound, C(17)H(18)N(4)O(2)S·CH(3)OH, the two benzene rings in the thio-carbonohydrazide mol-ecule form a dihedral angle of 22.42?(18)°. Pairs of N-H?S hydrogen bonds link thio-carbonohydrazide mol-ecules into centrosymmetric dimers. Methanol solvent mol-ecules serve as donors (O-H?S and O-H?N) and acceptors (N-H?O and C-H?O) of weak inter-molecular hydrogen bonds, which link further these dimers into double ribbons along the b axis.

| S-EPMC3213573 | biostudies-literature

1,5-Bis(1-phenyl-ethyl-idene)thio-carbono-hydrazide.

Project description:The title mol-ecule, C(17)H(18)N(4)S, is not planar, as indicated by the dihedral angle of 27.24?(9)° between the two benzene rings. In the crystal, inter-molecular N-H?S hydrogen bonds link pairs of mol-ecules into inversion dimers.

| S-EPMC3120603 | 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