Geometry & MOs

Info

ID:	161152
PubChem CID:	57390897
Reduced:	OC21H34 (1)
Stoich.:	AB21C34 (1)
Weight, g/mol:	465.168856
ΔH_f, kcal/mol:	-66.0
Dipole, Da:	3.89
IP(EA), eV:	-8.98(1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-carbazol-9-yl-2-hydroxypropyl)-N-(4-nitrophenyl)benzamide

Drug info:

PubChemData

Smile

CC1=C(C(CCC1)(C)C)/C=C/C(=C/C(C)C/C(=C\CO)/C)/C

DOS

IR

Vibrations