Browse
Submit Data
Databases
API
Help

Dataset Information

24 Views

0 Connections

0 Citations

0 Reanalyses

0 Downloads

Omics score: 0

2-Hy-droxy-5-nitro-N-phenyl-benzamide.

ABSTRACT: The mol-ecule of the title compound, C(13)H(10)N(2)O(4), is almost planar with a dihedral angle between the benzene rings of 1.99?(13)°. The nitro group and its parent benzene ring are oriented at a dihedral angle of 7.6?(3)°. Intra-molecular C-H?O and N-H?O hydrogen bonds form two planar S(6) motifs. Inter-molecular O-H?O=C hydrogen bonds join mol-ecules into chains extending along the c axis.

SUBMITTER: Raza AR

PROVIDER: S-EPMC3007066 | biostudies-literature | 2010 Jun

REPOSITORIES: biostudies-literature

ACCESS DATA

Json Xml

Publications

2-Hy-droxy-5-nitro-N-phenyl-benzamide.

Raza Abdul Rauf AR Nisar Bushra B Tahir M Nawaz MN

Acta crystallographica. Section E, Structure reports online 20100626 Pt 7

The mol-ecule of the title compound, C(13)H(10)N(2)O(4), is almost planar with a dihedral angle between the benzene rings of 1.99 (13)°. The nitro group and its parent benzene ring are oriented at a dihedral angle of 7.6 (3)°. Intra-molecular C-H⋯O and N-H⋯O hydrogen bonds form two planar S(6) motifs. Inter-molecular O-H⋯O=C hydrogen bonds join mol-ecules into chains extending along the c axis. ...[more]

PMID: 21588050

Similar Datasets

2-Hy-droxy-N-(3-nitro-phen-yl)benzamide.

Project description:In the crystal structure of title compound, C(13)H(10)N(2)O(4), as expected, the nitro- and hy-droxy-substituted benzene rings are planar with r. m. s. deviations of 0.0037 and 0.0014 Å, respectively, but are twisted slightly relative to each other, making a dihedral angle of 12.23 (7)°. The nitro group is only slightly twisted [by 2.71 (16)°] with respect to its parent ring. An intra-molecular N-H⋯O hydrogen bond forms an S(6) ring motif. Inter-molecular N-H⋯O and O-H⋯O hydrogen bonds build up sheets parallel to the ab plane. Futhermore, weak π-π inter-actions [centroid-centroid distances = 3.7150 (8) 3.7342 (6) and 3.9421 (8) Å] between the rings yield a three-dimensional network.

| S-EPMC3007834 | biostudies-literature

N-(4-Hy-droxy-phen-yl)-4-nitro-benzamide.

Project description:The mol-ecular structure of the title compound, C13H10N2O4, shows an almost planar conformation as the benzene rings make a dihedral angle of 2.31 (7)°. The nitro group lies in plane with the benzamide ring, with a C-C-N-O torsion angle of 0.6 (2)°. In the crystal, N-H⋯O and O-H⋯O hydrogen bonds link mol-ecules into sheets stacked along [10-1].

| S-EPMC3629581 | biostudies-literature

4-Nitro-phenyl 4-hy-droxy-3-methyl-benzoate.

Project description:The asymmetric unit of the title compound, C14H11NO5, contains two independent mol-ecules in which the dihedral angles between the benzene rings are 89.27 (16) and 77.14 (12)°. In the crystal, mol-ecules are linked by O-H⋯O hydrogen bonds, generating C(8) chains propagating in [010] for one mol-ecule and [001] C(8) chains for the other. The chains are connected by C-H⋯O hydrogen bonds and π-π inter-actions [shortest centroid-centroid distance = 3.5908 (12)°], generating a three-dimensional network.

| S-EPMC3589062 | biostudies-literature

2-Hy-droxy-N-(2-hy-droxy-eth-yl)benzamide.

Project description:In the title compound, C(9)H(11)NO(3), a derivative of salicyl-amide, the intra-cyclic C-C-C angles span the range 117.96?(13)-121.56?(14)°. An intra-molecular O-H?O hydro-gen bond occurs. In the crystal, inter-molecular O-H?O and N-H?O hydrogen bonds occur and C-H?O contacts connect the mol-ecules into a three-dimensional network. The closest inter-centroid distance between two ?-systems is 3.8809?(10)?Å.

| S-EPMC3213558 | biostudies-literature

4-Hy-droxy-N-methyl-benzamide.

Project description:Three independent mol-ecules comprise the asymmetric unit of the title compound, C8H9NO2, in which the dihedral angles between the amide group and the benzene ring are 3.0 (2), 4.0 (3) and 3.3 (9)°. In the crystal, O-H⋯O hydrogen bonds and weak C-H⋯N inter-actions are observed, forming infinite chains along [101].

| S-EPMC3648269 | biostudies-literature

4-Hy-droxy-benzamide 1,4-dioxane hemisolvate.

Project description:The asymmetric unit of the title compound, C(7)H(7)NO(2)·0.5C(4)H(8)O(2), is composed of one 4-hy-droxy-benzamide mol-ecule and half of a 1,4-dioxane mol-ecule. The complete dioxin molecule is generated by crystallographic inversion symmetry. The crystal has an extensive system of hydrogen bonds, in which the three donor H atoms are fully utilized: these result in amide-amide homodimers, and N-H⋯O(dioxane) and O-H⋯O(amide) links.

| S-EPMC3435686 | biostudies-literature

3-Hy-droxy-2-meth-oxy-benzamide.

Project description:The crystal structure of the title compound, C8H9NO3, features centrosymmetric dimers with two amide groups inter-connected by a pair of almost linear N-H⋯O hydrogen bonds. Through inter-molecular O-H⋯O inter-actions between phenolic hy-droxy groups and carbonyl O atoms, these dimers are assembled into undulating hydrogen-bonded layers parallel to the [101] plane. Additionally, the anti-H(-N) atom of the primary amide group forms an intra-molecular hydrogen bond to the O atom of the meth-oxy group. The amide group froms a dihedral angle of 12.6 (1)° with the phenyl ring.

| S-EPMC3589065 | biostudies-literature

2-Hy-droxy-N'-(4-hy-droxy-3-nitro-benzyl-idene)benzohydrazide.

Project description:The title compound, C(14)H(11)N(3)O(5), crystallized with two independent mol-ecules per asymmetric unit. Each mol-ecule assumes an E configuration with respect to the methyl-idene unit. Intra-molecular O-H⋯O and N-H⋯O hydrogen bonds are present in each mol-ecule and they are linked by an O-H⋯O hydrogen bond. The dihedral angles between the mean planes of the two benzene rings are 4.45 (16) and 1.7 (2)° in the two mol-ecules. The crystal structure is stabilized by inter-molecular O-H⋯O and N-H⋯O hydrogen bonds.

| S-EPMC3051712 | biostudies-literature

4-Hy-droxy-N'-(4-hy-droxy-3-nitro-benzyl-idene)benzohydrazide.

Project description:The mol-ecule of the title compound, C(14)H(11)N(3)O(5), assumes an E configuration with respect to the methyl-idene unit. An intra-molecular O-H⋯O hydrogen bond is present in the mol-ecule. The dihedral angle between the mean planes of the two benzene rings is 5.46 (15)°. The crystal structure is stabilized by inter-molecular O-H⋯O, O-H⋯N, and N-H⋯O hydrogen bonds.

| S-EPMC3051539 | biostudies-literature

N,N'-(2-Hy-droxy-propane-1,3-di-yl)bis-(2-hy-droxy-benzamide) monohydrate.

Project description:In the title hydrate, C17H18N2O5·H2O, the complete organic mol-ecule is generated by a crystallographic mirror plane with one C and one O atom lying on the mirror plane. The O atom of the water mol-ecule has m site symmetry. Two symmetry-related intra-molecular O-H?O hydrogen bonds complete S(6) rings in the organic mol-ecule. In the crystal, the components are linked into (010) sheets by O-H?O and N-H?O hydrogen bonds.

| S-EPMC3790446 | 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