Browse
Submit Data
Databases
API
Help

Dataset Information

19 Views

0 Connections

0 Citations

0 Reanalyses

0 Downloads

Omics score: 0

(E)-4-Nitro-benzaldehyde oxime.

ABSTRACT: In the title compound, C(7)H(6)N(2)O(3), the planes containing the CNO and ONO atoms subtend dihedral angles of 5.47 (5) and 8.31 (5)°, respectively, with the benzene ring. In the crystal structure, inter-molecular O-H⋯N hydrogen bonds link the mol-ecules into centrosymmetric dimers with an R(2) (2)(6) graph-set motif.

SUBMITTER: Abbas A

PROVIDER: S-EPMC2979095 | biostudies-literature |

REPOSITORIES: biostudies-literature

ACCESS DATA

Json Xml

Similar Datasets

2,6-Dichloro-benzaldehyde oxime.

Project description:In the title compound, C(7)H(5)Cl(2)NO, there are two mol-ecules in the asymmetric unit. The mol-ecules are essentially identical. Each mol-ecule is connected to a symmetry-related mol-ecule through an inversion center by O-H⋯N hydrogen bonds, building an R(2) (2)(6) graph-set motif.

| S-EPMC2959647 | biostudies-literature

(E)-2-Bromo-benzaldehyde oxime.

Project description:The configuration of the C=N double bond of the title compound, C(7)H(6)BrNO, is E; the non-H atoms are approximately coplanar (r.m.s. deviation = 0.038?Å). In the crystal, pairs of mol-ecules are linked by a pair of O-H?N hydrogen bonds about a center of inversion, generating hydrogen-bonded dimers.

| S-EPMC3200743 | biostudies-literature

(E)-3,5-Dimeth-oxy-benzaldehyde oxime.

Project description:In the title compound, C(9)H(11)NO(3), the oxime grouping is twisted by 12.68?(6)° with respect to the dimethoxyl-benzene ring. In the crystal, mol-ecules are linked into an infinite [100] chain via O-H?N hydrogen bonds, instead of the more common oxime packing motif of dimers with an R(2) (2)(6) graph-set motif.

| S-EPMC3009152 | biostudies-literature

2-Bromo-3-nitro-benzaldehyde.

Project description:The title compound, C(7)H(4)BrNO(3), was isolated as a by-product while attempting to prepare a diselenide. There is a close intra-molecular Br?O contact [2.984?(2)?Å]. The mol-ecules form loosely associated dimers held together by weak inter-molecular Br?O inter-actions with the nitro O atoms [Br?O = 3.179?(3)?Å]. As a result of these inter-actions, there is also a close Br?Br inter-molecular contact [3.8714?(6)?Å]. In addition, there are weak inter-molecular C-H?O inter-actions. The combination of these inter-actions produces sheets which propagate in the (210) and (10) directions perpendicular to c.

| S-EPMC2971273 | biostudies-literature

3-Nitro-benzaldehyde thio-semicarbazone.

Project description:The mol-ecule of the title compound, C(8)H(8)N(4)O(2)S, adopts an E configuration about both the C-N bonds. In the crystal structure, adjacent mol-ecules are linked by inter-molecular N-H?S hydrogen-bonding inter-actions, forming chains running parallel to the b axis.

| S-EPMC2968075 | biostudies-literature

4-Methyl-3-nitro-benzaldehyde.

Project description:In the crystal structure of the title compound, C(8)H(7)NO(3), mol-ecules are linked through weak inter-molecular C-H⋯O hydrogen bonding.

| S-EPMC3008133 | biostudies-literature

2-Hy-droxy-3-nitro-benzaldehyde.

Project description:The title compound, C(7)H(5)NO(4), isolated from the leaves of Actephila merrilliana, is essentially planar (r.m.s. deviation = 0.026 Å). The conformation is supported by an intra-molecular O-H⋯O hydrogen bond, which generates an S(6) ring. In the crystal, C-H⋯O inter-actions and aromatic π-π stacking [centroid-centroid distance = 3.754 (4) Å] help to establish the packing.

| S-EPMC3007554 | biostudies-literature

4-Hydr-oxy-3-nitro-benzaldehyde.

Project description:The hydroxyl group in each of the two independent mol-ecules of the title compound, C(7)H(5)NO(4), participates in two O-H⋯O hydrogen bonds, viz. one intra-molecular bond to the nitro group and one inter-molecular bond to the aldehyde group of the same mol-ecule in the next unit, resulting in a linear chain structure. The dihedral angle between the aromatic ring and the nitro group is 10.9 (3)° in one mol-ecule and 9.9 (2)° in the other.

| S-EPMC2961275 | biostudies-literature

5-Nitro-2-(piperidin-1-yl)benzaldehyde.

Project description:In the structure of the title compound, C(12)H(14)N(2)O(3), the piperidine ring adopts a chair conformation and the aryl substitutent occupies an equatorial position.

| S-EPMC2971290 | biostudies-literature

2-Chloro-5-nitro-benzaldehyde thio-semicarbazone.

Project description:The title Schiff base compound, C(8)H(7)ClN(4)O(2)S, was prepared by the reaction of equimolar quanti-ties of 2-chloro-5-nitro-benzaldehyde with thio-semicarbazide in methanol. The mol-ecule adopts a trans configuration with respect to the azomethine group and the dihedral angle between the benzene ring and the thio-semicarbazide group is 6.8 (3)°. In the crystal, mol-ecules are linked through inter-molecular N-H⋯S hydrogen bonds, forming chains propagating in [010].

| S-EPMC2983295 | 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