Geometry & MOs

Info

ID:	72256
PubChem CID:	48415976
Reduced:	ClON5H18C19 (1)
Stoich.:	ABC5D18E19 (1)
Weight, g/mol:	335.199762
ΔH_f, kcal/mol:	46.14
Dipole, Da:	6.56
IP(EA), eV:	-8.68(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(1H-benzimidazol-2-yl)propyl]-N-methyl-4-phenylbutanamide

Drug info:

PubChemData

Smile

CN(CCCC1=NC2=CC=CC=C2N1)C(=O)C3=C(N=C4N3C=CC=C4)Cl

DOS

IR

Vibrations