Geometry & MOs

Info

ID:	72244
PubChem CID:	48415964
Reduced:	OSN3C18H21 (1)
Stoich.:	ABC3D18E21 (1)
Weight, g/mol:	371.130363
ΔH_f, kcal/mol:	3.43
Dipole, Da:	9.1
IP(EA), eV:	-8.52(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(SC(=C1)C(=O)N(C)CCCC2=NC3=CC=CC=C3N2)C

DOS

IR

Vibrations