Browse
Submit Data
Databases
API
Help

Dataset Information

0 Views

0 Connections

0 Citations

0 Reanalyses

0 Downloads

Omics score: 0

[4-(1-Benzofuran-2-yl)phen-yl]diphenyl-amine.

ABSTRACT: The asymmetric unit of the title compound, C(26)H(19)NO, contains two mol-ecules. The dihedral angles between the benzofuran and benzene rings are 5.09?(8), 59.02?(8) and 67.74?(8)° in one mol-ecule and 18.70?(8), 52.78?(8) and 41.74?(8)° in the other. Weak inter-molecular C-H?? inter-actions help to stabilize the molecular structure .

SUBMITTER: Huang PH

PROVIDER: S-EPMC3050365 | biostudies-literature | 2010 Dec

REPOSITORIES: biostudies-literature

ACCESS DATA

Json Xml

Publications

[4-(1-Benzofuran-2-yl)phen-yl]diphenyl-amine.

Huang Ping-Hsin PH Lin Kai-Ling KL Wen Yuh-Sheng YS

Acta crystallographica. Section E, Structure reports online 20101211 Pt 1

The asymmetric unit of the title compound, C(26)H(19)NO, contains two mol-ecules. The dihedral angles between the benzofuran and benzene rings are 5.09 (8), 59.02 (8) and 67.74 (8)° in one mol-ecule and 18.70 (8), 52.78 (8) and 41.74 (8)° in the other. Weak inter-molecular C-H⋯π inter-actions help to stabilize the molecular structure . ...[more]

PMID: 21522620

Similar Datasets

(2-{[2-(diphenyl-phosphino)phen-yl]thio}-phen-yl)diphenyl-phosphine sulfide.

Project description:In the title compound, C(36)H(28)P(2)S(2), the dihedral angle between the central benzene rings is 66.95?(13)°. In the crystal, molecules are linked via C(ar)-H?? and ?-? inter-actions [shortest centroid-centroid distance between benzene rings = 3.897?(2)?Å].

| S-EPMC3515196 | biostudies-literature

Chlorido{N-[(E)-2-(diphenyl-phosphan-yl)benzyl-idene]-2-(thio-phen-2-yl)ethan-amine-?P}gold(I).

Project description:The title compound, [AuCl(C(25)H(22)NPS)], crystallizes with two independent mol-ecules in the asymmetric unit in which the thio-phene fragments are disordered over two sets of sites with 0.537?(10):0.463?(10) and 0.701?(9):0.299?(9) occupancy ratios. In both cases, the thio-phene ring is rotated by approximately 180° for the second component. Important geometrical parameters include Au-P = 2.235?(2) and 2.237?(2)?Å, Au-Cl = 2.286?(2) and 2.292?(2)?Å, and P-Au-Cl = 177.39?(8) and 172.63?(7)°. Weak inter-molecular C-H?Cl inter-actions are observed in the crystal structure.

| S-EPMC3254317 | biostudies-literature

(2,4-Dichloro-phen-yl)(diphenyl-phosphor-yl)methanol.

Project description:In the title compound, C(19)H(15)Cl(2)O(2)P, the dihedral angle between the mean planes of the phenyl rings bonded to the P atom is 75.4 (1)°. In the crystal, mol-ecules are linked into chains running along the a axis by inter-molecular O-H⋯O hydrogen bonds. Mol-ecules are further connected into a three-dimensional array by weak C-H⋯O inter-actions.

| S-EPMC2979971 | biostudies-literature

(Diphenyl-phosphor-yl)(2-nitro-phen-yl)methanol.

Project description:In the title compound, C(19)H(16)NO(4)P, the dihedral angle between the mean planes of the phenyl rings bonded to the P atom is 75.4 (1)°. In the crystal, mol-ecules are linked into chains running along the a axis by inter-molecular O-H⋯O hydrogen bonds. Mol-ecules are further connected into a three-dimensional array by weak C-H⋯O hydrogen bonds.

| S-EPMC3008110 | biostudies-literature

N-{2-[(4S)-4-tert-Butyl-4,5-dihydro-1,3-oxazol-2-yl]phen-yl}-5,6-diphenyl-1,2,4-triazin-3-amine.

Project description:The title compound, C(28)H(27)N(5)O, was synthesized using palladium cross-coupling amination of 3-bromo-5,6-diphenyl-1,2,4-triazine with 2-[(4S)-4-tert-butyl-4,5-dihydro-1,3-oxazol-2-yl]aniline. The oxazoline ring is almost planar, with a maximum atomic deviation of 0.023 (5) Å. The phenyl rings make dihedral angles of 29.0 (1) and 54.6 (1)° with the triazine ring while the benzene ring makes a dihedral angle of 0.6 (1)° with the oxazoline ring. The conformation of the mol-ecule is influenced by strong intra-molecular N-H⋯N and weak C-H⋯N hydrogen bonds. In the crystal, screw-axis related mol-ecules are linked into supra-molecular chains by inter-molecular C-H⋯O hydrogen bonds. π-π stacking is observed between the oxazoline and triazine rings of adjacent mol-ecules, with a centroid-centroid distance of 3.749 (2) Å.

| S-EPMC3052057 | biostudies-literature

N,N-Bis(diphenyl-phosphan-yl)benzyl-amine.

Project description:In the title compound, C(31)H(27)NP(2), the diphenyl-phosphanyl groups are staggered relative to the PNP backbone. The N atom is displaced by 0.219 (2) Å from the plane formed by the two P atoms and the methylene C atom. The angles around the N atom are 120.84 (16), 113.29 (16) and 120.57 (12)°, indicating that it exhibits a distorted trigonal-pyramidal geometry. There are no classical inter-molecular inter-actions.

| S-EPMC3051494 | biostudies-literature

(S)-1-Diphenyl-phosphanyl-2-{(S)-[2-(diphenyl-phosphan-yl)phen-yl]hydroxy-meth-yl}ferrocene.

Project description:The absolute configuration of the title compound, [Fe(C(5)H(5))(C(36)H(29)OP(2))], is S(p) at the ferrocene group and S at the asymmetric C atom. Both P atoms have a trigonal-pyramidal conformation. There is a short intra-molecular C-H⋯P contact with an H⋯P distance of 2.56 Å. The hydr-oxy group is involved in an intra-molecular O-H⋯π(phen-yl) inter-action. The crystal packing shows five very weak inter-molecular C-H⋯π contacts, with H⋯Cg distances between 3.26 and 3.39 Å (Cg is the centroid of a phenyl or cyclo-penta-dienyl ring).

| S-EPMC2959966 | biostudies-literature

[4-(Dimethyl-amino)-phen-yl]diphenyl-phosphine selenide.

Project description:In the title compound, C(20)H(20)NPSe, the P atom lies in a distorted tetra-hedral environment. The Tolman cone angle is 157° indicating steric crowding at this atom. In the crystal, weak C-H?Se inter-actions create linked dimeric units and C-H?? inter-actions are also observed.

| S-EPMC3515250 | biostudies-literature

4-(4-Chloro-phen-yl)-2,6-diphenyl-pyridine.

Project description:In the title compound, C(23)H(16)ClN, the crystal packing exhibits no significantly short inter-molecular contacts. The benzene rings show a disrotatory arrangement and the angles between them and the pyridine ring range from 20.80?(3) to 37.56?(4)°. The Cl atom deviates by 0.01?(3)?Å from the plane of the benzene ring to which it is attached.

| S-EPMC2915249 | biostudies-literature

N-(2,6-Dimethyl-phen-yl)-2,2-diphenyl-acetamide.

Project description:In the title compound, C(22)H(21)NO, the dihedral angle between the phenyl rings is 82.59?(7)°. The dimethyl-benzene ring forms dihedral angles of 52.86?(4) and 49.65?(5)° with the two phenyl rings. In the crystal, mol-ecules are linked by N-H?O hydrogen bonds, forming a C(4) chain along the c axis. The crystal also features C-H?? inter-actions.

| S-EPMC3344437 | 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