Geometry & MOs

Info

ID:	72215
PubChem CID:	48415933
Reduced:	O2N5C20H25 (1)
Stoich.:	A2B5C20D25 (1)
Weight, g/mol:	367.171834
ΔH_f, kcal/mol:	-16.02
Dipole, Da:	3.16
IP(EA), eV:	-9.08(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(1H-benzimidazol-2-yl)propyl]-N-methyl-2-[(4-methylphenyl)methylsulfanyl]acetamide

Drug info:

PubChemData

Smile

CCCCN1C(=O)C=CC(=N1)C(=O)N(C)CCCC2=NC3=CC=CC=C3N2

DOS

IR

Vibrations