Geometry & MOs

Info

ID:	72094
PubChem CID:	48415805
Reduced:	OSN3C21H25 (1)
Stoich.:	ABC3D21E25 (1)
Weight, g/mol:	341.156184
ΔH_f, kcal/mol:	4.59
Dipole, Da:	2.44
IP(EA), eV:	-8.76(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations