Geometry & MOs

Info

ID:	72177
PubChem CID:	48415893
Reduced:	O2N3C19H21 (1)
Stoich.:	A2B3C19D21 (1)
Weight, g/mol:	359.163377
ΔH_f, kcal/mol:	-17.18
Dipole, Da:	7.72
IP(EA), eV:	-8.95(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(1H-benzimidazol-2-yl)propyl]-3-hydroxy-N-methylnaphthalene-2-carboxamide

Drug info:

PubChemData

Smile

CN(CCCC1=NC2=CC=CC=C2N1)C(=O)C3=CC=CC=C3OC

DOS

IR

Vibrations