Geometry & MOs

Info

ID:	394566
PubChem CID:	135023236
Reduced:	O2N5C27H34 (1)
Stoich.:	A2B5C27D34 (1)
Weight, g/mol:	307.1361
ΔH_f, kcal/mol:	-18.43
Dipole, Da:	5.66
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.782968
Charge, e:	0

Chem-info

IUPAC name:

2-phenyl-6-(2-phenylphenyl)pyridine

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1)C)N2C=[N+]3[C@@H](CCC3=N2)CCC(=O)N[C@@H](CC4=CC=CC=C4)C(=O)NC)C

DOS

IR

Vibrations