Geometry & MOs

Info

ID:	143000
PubChem CID:	53131325
Reduced:	O2N3C21H25 (1)
Stoich.:	A2B3C21D25 (1)
Weight, g/mol:	399.09462
ΔH_f, kcal/mol:	-44.58
Dipole, Da:	5.96
IP(EA), eV:	-8.55(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-bromo-2-methylphenyl)-3-(2-propan-2-yl-3H-benzimidazol-5-yl)propanamide

Drug info:

PubChemData

Smile

CCOC1=CC=CC=C1NC(=O)CCC2=CC3=C(C=C2)N=C(N3)C(C)C

DOS

IR

Vibrations