Geometry & MOs

Info

ID:	71978
PubChem CID:	48415679
Reduced:	N3O3C22H25 (1)
Stoich.:	A3B3C22D25 (1)
Weight, g/mol:	343.168462
ΔH_f, kcal/mol:	-61.29
Dipole, Da:	3.21
IP(EA), eV:	-9.12(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC(=O)C1=CC=C(C=C1)OCC(=O)N(C)CCCC2=NC3=CC=CC=C3N2

DOS

IR

Vibrations