Browse
Submit Data
Databases
API
Help

Dataset Information

10 Views

0 Connections

0 Citations

0 Reanalyses

0 Downloads

Omics score: 0

4-{Phen-yl[4-(6-phenyl-2,2'-bipyridin-4-yl)phen-yl]amino}-benzaldehyde.

ABSTRACT: The title mol-ecule, C35H25N3O, is a tri-phenyl-amine derivative with the 4-position substituted by an aldehyde group, and the 4'-position substituted by a 6-phenyl-2,2'-bi-pyridine group. The whole mol-ecule is non-planar and the dihedral angle between the core benzene and pyridine rings is 36.96?(5)°. The dihedral angle between the phenyl and benzaldehyde groups bonded to the amine N atom is 70.86?(5)°.

SUBMITTER: Zhang YY

PROVIDER: S-EPMC4158477 | biostudies-literature | 2014 Aug

REPOSITORIES: biostudies-literature

ACCESS DATA

Json Xml

Publications

4-{Phen-yl[4-(6-phenyl-2,2'-bipyridin-4-yl)phen-yl]amino}-benzaldehyde.

Zhang Yu-Yang YY Pan Jian-Ting JT Huang Jian-Yan JY

Acta crystallographica. Section E, Structure reports online 20140702 Pt 8

The title mol-ecule, C35H25N3O, is a tri-phenyl-amine derivative with the 4-position substituted by an aldehyde group, and the 4'-position substituted by a 6-phenyl-2,2'-bi-pyridine group. The whole mol-ecule is non-planar and the dihedral angle between the core benzene and pyridine rings is 36.96 (5)°. The dihedral angle between the phenyl and benzaldehyde groups bonded to the amine N atom is 70.86 (5)°. ...[more]

PMID: 25249893

Similar Datasets

4-{Eth-yl[(E)-4-(4-pyridylvin-yl)phenyl]-amino}benzaldehyde.

Project description:In the title mol-ecule, C(22)H(20)N(2)O, the central aromatic ring forms dihedral angles of 45.30?(2) and 69.43?(2)°, respectively, with the outer pyridine and benzene rings. In the crystal structure, weak inter-molecular C-H?O inter-actions link the mol-ecules into layers parallel to the ab plane.

| S-EPMC2959691 | biostudies-literature

4-[4-(Methyl-sulfan-yl)phen-yl]-6-phenyl-2,2'-bipyridine.

Project description:The structure of the title compound, C(23)H(18)N(2)S, is revealed by X-ray diffraction to be almost planar over all four aromatic rings; the pendant rings are at angles of 10.18, 14.12 and 15.42° relative to the central pyridine ring for the 4-methylsulfanyl, 2-pyridyl and 6-phenyl rings, respectively. The 2,6-aromatic substituents are disordered over two sites in a 0.6:0.4 occupancy ratio.

| S-EPMC2915332 | biostudies-literature

N-[(3-Ethyl-phen-yl)carbamo-thio-yl]-2,2-di-phenyl-acetamide.

Project description:In the title mol-ecule, C23H22N2OS, the di-phenyl-acetyl and ethyl-benzene groups adopt a trans-cis conformation, respectively, with respect to the S atom across the (S=)C-N bonds. This conformation is stabilized by an intra-molecular N-H?O hydrogen bond and a weak C-H?S hydrogen bond. The ethyl-substituted benzene ring forms dihedral angles of 87.53?(15) and 73.94?(15)° with the phenyl rings. In the crystal, N-H?O hydrogen bonds link mol-ecules into chains along [100]. A weak C-H?? inter-action is also observed.

| S-EPMC3772456 | biostudies-literature

{4'-[4-(4,4'-Bipyridin-1-ylmeth-yl)phen-yl]-2,2':6',2''-terpyridine}chloridoplatinum(II) bis-(perchlorate) acetonitrile disolvate sesquihydrate.

Project description:The asymmetric unit of the title compound, [PtCl(C(32)H(24)N(5))](ClO(4))(2)·2CH(3)CN·1.5H(2)O, comprises two unique Pt(II) complex cations, four perchlorate anions, four acetonitrile solvent mol-ecules and three water mol-ecules. The Pt atom is four-coordinated by a tridentate chelating 2,2':6',2''-terpyridine ligand and a chloride ion in a square-planar geometry with modest distortion imposed by the constraint of the terpyridyl ligand. The r.m.s. deviations from the plane comprising the four ligand donor atoms and the Pt atom are 0.0381 and 0.0472?Å in the two complex cations.

| S-EPMC2979511 | biostudies-literature

N-[(2,6-Di-ethyl-phen-yl)carbamo-thio-yl]-2,2-di-phenyl-acetamide.

Project description:In the title compound, C25H26N2OS, the diethyl-substituted benzene ring forms dihedral angles of 67.38?(9) and 55.32?(9)° with the terminal benzene rings. The mol-ecule adopts a trans-cis conformation with respect to the orientations of the di-phenyl-methane and 1,3-di-ethyl-benzene groups with respect to the S atom across the C-N bonds. This conformation is stabilized by an intra-molecular N-H?O hydrogen bond, which generates an S(6) ring. In the crystal, pairs of N-H?S hydrogen bonds link the mol-ecules into inversion dimers, forming R 2 (2)(6) loops. The dimer linkage is reinforced by a pair of C-H?S hydrogen bonds, which generate R 2 (2)(8) loops. Weak C-H?? and ?-? [centroid-centroid seperation = 3.8821?(10)?Å] inter-actions also occur in the crystal structure.

| S-EPMC3685105 | biostudies-literature

2-{(E)-[4-(Di-phenyl-amino)-phen-yl]imino-meth-yl}phenol.

Project description:The asymmetric unit of the title Schiff base molecule, C25H20N2O, contains two independent mol-ecules. In each mol-ecule, the C=N bond is in an E conformation. The most significant difference between the two mol-ecules is seen for the dihedral angles between the meth-oxy-substituted benzene ring and the two phenyl rings, which are 85.5?(1) and 82.3?(1)° in the first mol-ecule, and 49.0?(1) and 40.4?(1)° in the second. This conformational difference is reflected in the central C=N-C C torsion angle, which is 28.7?(2)° in the first mol-ecule and -29.8?(3)° in the other. In each mol-ecule, there is an intra-molecular O-H?N hydrogen bond.

| S-EPMC3998446 | biostudies-literature

{?-N-[(Diphenyl-phosphino)meth-yl]pyridin-2-amine-?N:P}bis-{[2-(2,2'-bipyridin-6-yl)phenyl-?N,N',C]platinum(II)} bis-(perchlorate).

Project description:The title compound, [Pt(2)(C(16)H(11)N(2))(2)(C(18)H(17)N(2)P)](ClO(4))(2), contains two Pt(II) atoms, bridged by an N-[(diphenyl-phosphino)meth-yl]pyridin-2-amine (dppmp) ligand. One Pt atom is coordinated by one P atom from the dppmp ligand, and one C atom and two N atoms from a 6-phenyl-2,2'-bipyridine (pbpy) ligand in a square-planar geometry. The other Pt atom is coordinated by one N atom from the dppmp ligand, and one C atom and two N atoms from another pbpy ligand in a square-planar geometry. There are intra-molecular ?-? inter-actions between the pbpy ligands, with a centroid-centroid distance of 3.62?(1)?Å between two pyridyl rings. The oxygen atoms of both perchlorate anions are disordered, each over two different positions [occupanicies 0.49?(3)/0.51?(3) and 0.48?(2)/0.52?(2)].

| S-EPMC2960491 | biostudies-literature

Diethyl 1-(4-methyl-phen-yl)-3-phenyl-5-oxopyrrolidine-2,2-dicarboxyl-ate.

Project description:In the title compound, C(23)H(25)NO(5), the lactam ring adopts an envelope conformation and both eth-oxy-carbonyl side chains show an s-cis conformation: one is nearly planar, the dihedral angle between CO(2) and OCH(2)CH(3) groups being 7.95?(14)° and the other is almost orthogonal, the C-O-C-C torsion angle being 85.33?(9)°. Dimers related by inversion symmetry are stabilized by C-H?O hydrogen bonds. The crystal structure is consolidated by weak intermolecular C-H?O inter-actions. Weak intra-molecular inter-actions of the same kind also occur.

| S-EPMC3007313 | biostudies-literature

4-(Diphenyl-amino)-benzaldehyde 4-phenyl-thio-semicarbazone.

Project description:The title mol-ecule, C(26)H(22)N(4)S, is composed of three main parts, viz. a triphenyl-amine group is connected to a phenyl ring by a thio-semicarbazone moiety. The C= N double bond has an E conformation. The crystal packing is dominated by strong hydrogen bonds through the thio-semicarbazone moiety, with pairs of N-H?S hydrogen bonds linking the mol-ecules to form inversion dimers with an R(2) (2)(8) ring motif. An intra-molecular N-H?N hydrogen bond is also present, generating an S(5) ring motif. Although the structure contains four phenyl rings, ?-? stacking inter-actions are not formed between them, probably due to the conformation adopted by the triphenyl-amine group. However, a weak ?-? stacking inter-action is observed between the phenyl ring and the delocalized thio-semicarbazone moiety.

| S-EPMC3414326 | biostudies-literature

[4'-(4-Amino-phen-yl)-2,2':6',2''-terpyridine]-chloridopalladium(II) chloride.

Project description:The Pd(II) atom in the complex cation of the title compound, [PdCl(C(21)H(16)N(4))]Cl, is coordinated by three N atoms derived from the terpyridine ligand and a chloride ion, which define a distorted PdClN(3) square-planar coordination geometry. In the crystal, the presence of N-H?Cl hydrogen bonds involving the amino H atom and chloride anions link two cations and two anions into a four-ion aggregate via centrosymmetric eight-membered [?H-N-H?Cl](2) synthons. Layers of cations are inter-spersed with the chloride anions with stabilization provided by C-H?Cl inter-actions involving both Cl atoms, as well as ?-? inter-actions [the closest inter-action of 3.489?(6)?Å occurs between a chelate ring and a pyridyl residue].

| S-EPMC3120294 | 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