Geometry & MOs

Info

ID:	72084
PubChem CID:	48415795
Reduced:	SO2N4C21H22 (1)
Stoich.:	AB2C4D21E22 (1)
Weight, g/mol:	375.140533
ΔH_f, kcal/mol:	-24.25
Dipole, Da:	8.28
IP(EA), eV:	-8.86(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1C(=O)NC2=C(S1)C=CC(=C2)C(=O)N(C)CCCC3=NC4=CC=CC=C4N3

DOS

IR

Vibrations