Geometry & MOs

Info

ID:	435936
PubChem CID:	135192892
Reduced:	OSN9H21C22 (1)
Stoich.:	ABC9D21E22 (1)
Weight, g/mol:	520.17045
ΔH_f, kcal/mol:	153.11
Dipole, Da:	11.12
IP(EA), eV:	-9.34(-1.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-[3-[phenyl-(3-pyridin-3-ylphenyl)phosphoryl]phenyl]carbazole

Drug info:

PubChemData

Smile

CC1=CC=C(S1)C2=CN=C3N2C=C(C=C3N4C(=NN=N4)C(C)C)C(=O)NCC5=NC=CN=C5

DOS

IR

Vibrations