Browse
Submit Data
Databases
API
Help

Dataset Information

13 Views

0 Connections

0 Citations

0 Reanalyses

0 Downloads

Omics score: 0

4-Chloro-N-(2-pyrid-yl)aniline.

ABSTRACT: There are two mol-ecules in the asymmetric unit of the title compound, C(11)H(9)ClN(2), with dihedral angles of 41.84 (12) and 49.24 (12)° between the aromatic ring planes. The two mol-ecules form a dimer via a pair of N-H⋯N hydrogen bonds.

SUBMITTER: Wan Saffiee WA

PROVIDER: S-EPMC2959926 | biostudies-literature |

REPOSITORIES: biostudies-literature

ACCESS DATA

Json Xml

Similar Datasets

N,N-Dimethyl-4-[(2-pyrid-yl)diazen-yl]aniline.

Project description:The title compound, C(13)H(14)N(4), adopts a trans configuration about the azo bond. There is a dihedral angle of 12.18?(7)° between the pyridine and benzene rings and the mean plane of the dimethyl-amino substituent is twisted by 6.1?(2)° relative to the benzene ring. In the crystal, weak inter-molecular C-H?N hydrogen bonds result in a zigzag arrangement along [010].

| S-EPMC3007196 | biostudies-literature

4-Methyl-3-[4-(3-pyrid-yl)pyrimidin-2-yl-oxy]aniline.

Project description:In the title compound, C(16)H(14)N(4)O, there are inter-molecular N-H?N hydrogen bonds which may be effective in stabilizing the crystal. The title compound is an important medicament and is used in the synthesis of anti-tumour drugs.

| S-EPMC2969253 | biostudies-literature

4-Chloro-N-(pyrimidin-2-yl)aniline.

Project description:The two aromatic rings in the title compound, C(10)H(8)ClN(3), open the angle at the planar N atom to 128.00?(12)°. The amino N atom of one mol-ecule forms a hydrogen bond to the 1-N atom of an adjacent pyrimidyl ring, generating a hydrogen-bonded dimer.

| S-EPMC2968001 | biostudies-literature

4-Chloro-N-(pyrazin-2-yl)aniline.

Project description:In the title compound, C(10)H(8)ClN(3), the dihedral angle between the aromatic rings is 43.0?(1)° and the bridging C-N-C angle is 128.19?(16)°. The amino N atom of one mol-ecule forms a hydrogen bond to the 1-N atom of an adjacent pyrazinyl ring, generating an inversion dimer.

| S-EPMC2968035 | biostudies-literature

3-Chloro-6-[4-(2-pyrid-yl)piperazin-1-yl]pyridazine.

Project description:In the title compound, C(13)H(14)ClN(5), the piperazine ring adopts a chair conformation and the dihedral angle between the aromatic rings is 13.91?(7)°. The crystal structure is stabilized by weak inter-molecular C-H?N hydrogen-bond inter-actions.

| S-EPMC2980189 | biostudies-literature

N-(2-Chloro-benzo-yl)-N'-(3-pyrid-yl)thio-urea.

Project description:In the mol-ecule of the title compound, C(13)H(10)ClN(3)OS, the dihedral angles between the plane through the thio-urea group and the pyridine and benzene rings are 53.08?(3) and 87.12?(3)°, respectively. The mol-ecules are linked by inter-molecular N-H?N hydrogen-bonding inter-actions to form a supra-molecular chain structure along the a axis. An intra-mol-ecular N-H?O hydrogen bond is also present.

| S-EPMC2962040 | biostudies-literature

4-[(4-Chloro-phen-yl)diazen-yl]-3-meth-oxy-aniline.

Project description:The title compound, C(13)H(12)ClN(3)O, exhibits a trans geometry about the N=N double bond in the solid state. The dihedral angle between the rings is 22.20?(8)°. Inter-molecular N-H?O hydrogen bonds between the amine and meth-oxy groups lead to the formation of a chain-like polymer along the c axis with a C(6) graph set. There is also weak non-classical C-H?N hydrogen bonds involving an aromatic C-H group and a diazenyl N atom, which connect the chains into a two-dimensional framework.

| S-EPMC3152038 | biostudies-literature

N-[(2-Chloro-3-quinol-yl)meth-yl]-4-fluoro-aniline.

Project description:In the title compound, C(16)H(12)ClFN(2), the dihedral angle between the quinoline ring system and the flourophenyl ring is 86.70?(4)°. In the crystal, mol-ecules are linked into chains along the a axis by N-H?N hydrogen bonds. In addition, C-H?? inter-actions involving the two benzene rings are observed.

| S-EPMC2983417 | biostudies-literature

N-Benzoyl-N'-(2-chloro-3-pyrid-yl)thio-urea.

Project description:The title compound, C(13)H(10)ClN(3)OS, was prepared by the reaction of 3-amino-2-chloropyridine with benzoyl isothio-cyanate at room temperature. The thio-urea group makes dihedral angles of 47.17?(5) and 51.88?(4)°, respectively, with the benzene and pyridyl rings, while the angle between the benzene and pyridine rings is 8.91?(3)°. Inter-molecular hydrogen-bond inter-actions link neighbouring mol-ecules into an infinite supra-molecular structure.

| S-EPMC2977241 | biostudies-literature

N-[2-Chloro-6-(4-chloro-6-methoxy-pyrimidin-2-ylsulfan-yl)benz-yl]-3,4-dimethyl-aniline.

Project description:In the title mol-ecule, C(20)H(19)Cl(2)N(3)OS, the dihedral angle between the two benzene rings is 79.3?(7)°. The 4-chloro-6-methoxy-pyrimidine group is rotationally disordered over two sites by approximately 180°, the ratio of the refined occupancies being 0.6772?(15):0.3228?(15). Both disorder components of disorder are involved in intra-molecular N-H?N hydrogen bonds.

| S-EPMC2971454 | 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