Browse
Submit Data
Databases
API
Help

Dataset Information

29 Views

0 Connections

0 Citations

0 Reanalyses

0 Downloads

Omics score: 0

3-[4-(Dimethyl-amino)benzyl-ideneamino]benzonitrile.

ABSTRACT: The mol-ecule of the title Schiff base, C(16)H(15)N(3), is non-planar and displays a trans configuration with respect to the C=N double bond. The two benzene rings make a dihedral angle of 49.24?(3)°.

SUBMITTER: Xu HJ

PROVIDER: S-EPMC2977646 | biostudies-literature | 2009 Apr

REPOSITORIES: biostudies-literature

ACCESS DATA

Json Xml

Publications

3-[4-(Dimethyl-amino)benzyl-ideneamino]benzonitrile.

Xu Hai-Jun HJ Tan Qin-Ying QY Cui Li-Jing LJ Qian Kun K

Acta crystallographica. Section E, Structure reports online 20090402 Pt 5

The mol-ecule of the title Schiff base, C(16)H(15)N(3), is non-planar and displays a trans configuration with respect to the C=N double bond. The two benzene rings make a dihedral angle of 49.24 (3)°. ...[more]

PMID: 21583989

Similar Datasets

(E)-4-[4-(Dimethyl-amino)benzyl-ideneamino]benzonitrile.

Project description:The mol-ecule of the title compound, C(16)H(15)N(3), displays a trans configuration with respect to the C=N double bond. The mol-ecule is not planar, the dihedral angle between the benzene rings being 57.83 (9)°. The crystal packing is stabilized only by van der Waals inter-actions.

| S-EPMC2972009 | biostudies-literature

2-(2-Hydroxy-benzyl-ideneamino)benzonitrile.

Project description:The mol-ecule of the title compound, C(14)H(10)N(2)O, displays a trans configuration with respect to the C=N double bond. The mol-ecule is roughly planar; the two aromatic rings make a dihedral angle of 9.3?(3)°. Such a planar conformation is induced by the strong intra-molecular O-H?N hydrogen bond between the imine and hydroxyl groups.

| S-EPMC2961580 | biostudies-literature

3-(2-Hydroxy-benzyl-ideneamino)benzonitrile.

Project description:In the title mol-ecule, C(14)H(10)N(2)O, an intra-molecular O-H?N hydrogen bond contributes to the essential coplanarity of the two benzene rings, which form a dihedral angle of 6.04?(18)°.

| S-EPMC2960747 | biostudies-literature

1,4-Bis{3-[4-(dimethyl-amino)benzyl-ideneamino]prop-yl}piperazine.

Project description:The mol-ecule of the title compound, C(28)H(42)N(6), has site symmetry with the centroid of the piperazine ring located on an inversion center. The piperazine ring adopts a chair conformation. The benzene ring and propyl-piperazine are on opposite sides of the C=N bond, showing an E configuration.

| S-EPMC2972073 | biostudies-literature

(E)-2-(2,4-Dihydroxy-benzyl-ideneamino)benzonitrile.

Project description:The mol-ecule of the title compound, C(14)H(10)N(2)O(2), adopts the phenol-imine tautomeric form. The dihedral angle between the planes of the two benzene rings is 13.84?(13)°. A strong intra-molecular O-H?N hydrogen-bonding inter-action stabilizes the mol-ecular conformation. In the crystal structure, centrosymmetrically related mol-ecules are linked into dimers by inter-molecular C-H?O and O-H?N hydrogen bonds.

| S-EPMC2969512 | biostudies-other

2-[(E)-(Dimethyl-amino)methyl-ene-amino]benzonitrile.

Project description:In the title compound, C(10)H(11)N(3), the amidine unit, including the two methyl substituents, is virtually planar [maximum deviation = 0.016?(5)?Å]. The plane of the benzene ring forms a dihedral angle of 46.5?(3)° with the amidine group.

| S-EPMC2969778 | biostudies-literature

4-(2-Hydroxy-benzyl-idene-amino)-benzonitrile.

Project description:The mol-ecule of the title compound, C(14)H(10)N(2)O, is nearly planar. There is a strong intra-molecular O-H?N hydrogen bond between the imine and hydr-oxy groups. The configuration with respect to the C=N double bond is anti (1E).

| S-EPMC2961783 | biostudies-literature

2-{[(Dimethyl-amino)-methyl-idene]amino}-5-nitro-benzonitrile.

Project description:The title mol-ecule, C10H10N4O2, is almost planar and adopts an E configuration of the azomethine [C=N = 1.298?(2)?Å] double bond. The benzene ring is attached to an essentially planar (r.m.s. deviation = 0.0226?Å) amidine moiety (N=CN/Me2), the dihedral angle between the two mean planes being 18.42?(11)°. The cyano group lies in the plane of the benzene ring [the C and N atoms deviating by 0.030?(3) and 0.040?(3)?Å, respectively], while the nitro group makes a dihedral angle 5.8?(3)° with the benzene ring. There are two distinct inter-molecular hydrogen bonds, C-H?O and C-H?N, that stabilize the crystal structure; the former inter-actions result in centrosymmetric dimers about inversion centers resulting in ten-membered rings, while the later give rise to chains of mol-ecules running parallel to the b axis.

| S-EPMC3588379 | biostudies-literature

4-[4-(Diethyl-amino)benzyl-ideneamino]-4H-1,2,4-triazole.

Project description:The title compound, C(13)H(17)N(5), is a Schiff base synthesized by the reaction of 4-amino-4H-1,2,4-triazole and 4-(diethyl-amino)benzaldehyde. The triazole ring forms a dihedral angle of 5.77?(16)° with the benzene ring. The crystal structure is stabilized by an inter-molecular C-H?N hydrogen bond.

| S-EPMC2961419 | biostudies-literature

(E)-2-(4-Diethyl-amino-2-hydroxy-benzyl-idene-amino)benzonitrile.

Project description:The mol-ecule of the title compound, C(18)H(19)N(3)O, displays a trans configuration with respect to the C=N double bond. The dihedral angle between the planes of the two benzene rings is 2.62?(11)°. A strong intra-molecular O-H?N hydrogen bond stabilizes the mol-ecular conformation.

| S-EPMC2983696 | 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