Geometry & MOs

Info

ID:	72146
PubChem CID:	48415861
Reduced:	ON3C19H21 (1)
Stoich.:	AB3C19D21 (1)
Weight, g/mol:	372.05857
ΔH_f, kcal/mol:	10.8
Dipole, Da:	2.38
IP(EA), eV:	-9.07(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(1H-benzimidazol-2-yl)propyl]-5-bromo-N-methylpyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1C(=O)N(C)CCCC2=NC3=CC=CC=C3N2

DOS

IR

Vibrations