Browse
Submit Data
Databases
API
Help

Dataset Information

17 Views

0 Connections

0 Citations

0 Reanalyses

0 Downloads

Omics score: 0

4-Meth-oxy-N-phenyl-aniline.

ABSTRACT: In the mol-ecule of the title compound, C(13)H(13)NO, the two benzene rings are oriented at a dihedral angle of 59.9?(2)°. In the crystal structure, the benzene rings of neighbouring mol-ecules are oriented nearly parallel or perpendicular, making dihedral angles of 2.8?(2) and 79.5?(2)°, respectively. The crystal structure is stabilized by a network of C-H?? and N-H?? inter-actions.

SUBMITTER: Krzyminski K

PROVIDER: S-EPMC2968066 | biostudies-literature | 2008 Dec

REPOSITORIES: biostudies-literature

ACCESS DATA

Json Xml

Publications

4-Meth-oxy-N-phenyl-aniline.

Krzymiński Karol K Wera Michał M Sikorski Artur A Błażejowski Jerzy J

Acta crystallographica. Section E, Structure reports online 20081217 Pt 1

In the mol-ecule of the title compound, C(13)H(13)NO, the two benzene rings are oriented at a dihedral angle of 59.9 (2)°. In the crystal structure, the benzene rings of neighbouring mol-ecules are oriented nearly parallel or perpendicular, making dihedral angles of 2.8 (2) and 79.5 (2)°, respectively. The crystal structure is stabilized by a network of C-H⋯π and N-H⋯π inter-actions. ...[more]

PMID: 21581610

Similar Datasets

4-Meth-oxy-3-(trifluoro-meth-yl)aniline.

Project description:In title compound, C(8)H(8)F(3)NO, the meth-oxy group is inclined at 8.7?(4)° to the benzene ring plane. The crystal structure is stabilized by inter-molecular N-H?F, N-H?N and C-H?F hydrogen-bonding inter-actions.

| S-EPMC3275055 | biostudies-literature

Phenyl 3-meth-oxy-4-phen-oxy-benzoate.

Project description:In the title mol-ecule, C(20)H(16)O(4), the two outermost phenyl rings form dihedral angles of 79.80?(7) and 69.35?(7)° with the central benzene ring. In the crystal structure, weak inter-molecular C-H?O inter-actions link the mol-ecules into ribbons propagating along [1[Formula: see text]0].

| S-EPMC3200648 | biostudies-literature

4-Meth-oxy-N-(2-nitro-benzyl-idene)aniline.

Project description:The title compound, C(14)H(12)N(2)O(3), was prepared by reaction of 2-nitro-benzaldehyde with 4-methoxy-benzenamine at 377?K. The molecule has an E configuration, with a dihedral angle between the two benzene rings of 43.3?(5)°. An intermolecular C-H?O interaction links molecules in zigzag chains down the a axis.

| S-EPMC2959339 | biostudies-literature

4-Meth-oxy-N-(4-nitro-benz-yl)aniline.

Project description:In the title compound, C(14)H(14)N(2)O(3), the nitro group is nearly coplanar with the benzene ring to which it is bonded [dihedral angle = 1.70 (2)°], and this ring is para-substituted by the amino-methyl-ene group. The dihedral angle between the benzene rings is 57.8 (1)°. The crystal structure is stabilized by N-H⋯O and C-H⋯O hydrogen bonds and weak C-H⋯π inter-actions are also observed.

| S-EPMC3343958 | biostudies-literature

4-Eth-oxy-phenyl 4-[(meth-oxy-carbon-yl)-oxy]benzoate.

Project description:In the title compound, C(17)H(16)O(6), the two benzene rings form a dihedral angle of 54.95?(10)°. Only weak inter-molecular inter-actions are present in the crystal structure, viz. C-H?O hydrogen bonds and C-H?? inter-actions involving one of the benzene rings.

| S-EPMC3011779 | biostudies-literature

N,N-Dimethyl-4-[(E)-phenyl-imino-meth-yl]aniline.

Project description:The title compound, C(15)H(16)N(2), contains two aromatic rings linked through an imino group. The mol-ecule exhibits an E configuration with respect to the C=N bond. The dihedral angle between the aromatic rings is 61.96?(1)°.

| S-EPMC2968577 | biostudies-literature

N-[(2-Chloro-8-methyl-quinolin-3-yl)meth-yl]-4-meth-oxy-aniline.

Project description:In the title compound, C(18)H(17)ClN(2)O, the quinoline ring system is essentially planar; the r.m.s. deviation for the non-H atoms is 0.04?Å with a maximum deviation from the mean plane of 0.026?(4)?Å for the C atom bonded to the -CH(2)- group. The meth-oxy-substituted benzene ring forms a dihedral angle of 70.22?(4)° with this ring system. The crystal structure can be described as zigzag layers in which the quinoline ring systems are parallel to (011) and molecules are connected via inter-molecular N-H?N hydrogen bonds, forming chains along [100]. The crystal studied was an inversion twin with a 0.86?(5):0.14?(5) domain ratio.

| S-EPMC3009236 | biostudies-literature

4-Meth-oxy-2-[(E)-(phenyl-imino)meth-yl]phenol.

Project description:In the mol-ecule of the title compound, C(14)H(13)NO(2), the two aromatic rings are oriented at a dihedral angle of 0.78?(20)°; with the exception of two methyl H atoms the mol-ecule is essentially planar. The intra-molecular O-H?N hydrogen bond results in the formation of a non-planar, six-membered ring, which adopts a flattened-boat conformation. In the crystal structure, inter-molecular C-H?O hydrogen bonds link the mol-ecules to form parallel networks. There is a C-H?? contact between the methyl group and the benzene ring. A ?-? contact between the benzene and phenyl rings [centroid-centroid distance = 4.681?(5)?Å] is also observed.

| S-EPMC2960573 | biostudies-literature

6-Meth-oxy-2-[(E)-phenyl-imino-meth-yl]phenol.

Project description:The title compound, C(14)H(13)NO(2), was obtained by the condensation reaction of o-vanillin and aniline in ethanol. The mol-ecule adopts the phenol-imine tautomeric form and an E conformation with respect to the azomethine C=N bond. The dihedral angle between the aromatic rings is 30.57?(10)°. In the crystal, mol-ecules are linked by inter-molecular C-H?O hydrogen bonds into zigzag chains parallel to the b axis.

| S-EPMC3099786 | biostudies-literature

S-Phenyl 4-meth-oxy-benzothio-ate.

Project description:In the mol-ecule of the title thio-ester, C(14)H(12)O(2)S, the dihedral angle between the phenyl and benzene rings is 71.8?(3)°. The meth-oxy group is essentially coplanar with the benezene ring to which it is bonded, with an r.m.s. deviation of 0.0065?(5)?Å for the non-H atoms involved. In the crystal, weak C-H?? inter-actions are present.

| S-EPMC3344030 | 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