Geometry & MOs

Info

ID:	315546
PubChem CID:	126627540
Reduced:	N4O4C29H32 (1)
Stoich.:	A4B4C29D32 (1)
Weight, g/mol:	662.247047
ΔH_f, kcal/mol:	-82.73
Dipole, Da:	2.6
IP(EA), eV:	-8.17(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[3-[9-[3-(6-phenylpyridin-2-yl)phenyl]carbazol-3-yl]carbazol-9-yl]benzonitrile

Drug info:

PubChemData

Smile

CC1C=C(C=C1C(=O)OC)NC(=O)C2=CC(=CN2C)CCCC(=O)C3=CC(=CN3C)C4=CC=C(C=C4)N

DOS

IR

Vibrations