Geometry & MOs

Info

ID:	72108
PubChem CID:	48415820
Reduced:	O2N3C21H25 (1)
Stoich.:	A2B3C21D25 (1)
Weight, g/mol:	401.07389
ΔH_f, kcal/mol:	-32.01
Dipole, Da:	5.2
IP(EA), eV:	-8.56(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(1H-benzimidazol-2-yl)propyl]-2-bromo-5-methoxy-N-methylbenzamide

Drug info:

PubChemData

Smile

CN(CCCC1=NC2=CC=CC=C2N1)C(=O)CCC3=CC=C(C=C3)OC

DOS

IR

Vibrations