Geometry & MOs

Info

ID:	72262
PubChem CID:	48415982
Reduced:	SO3N5C19H23 (1)
Stoich.:	AB3C5D19E23 (1)
Weight, g/mol:	405.151098
ΔH_f, kcal/mol:	-47.31
Dipole, Da:	5.92
IP(EA), eV:	-9.07(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(1H-benzimidazol-2-yl)propyl]-N-methyl-3-(thiophen-2-ylmethoxy)benzamide

Drug info:

PubChemData

Smile

CN(CCCC1=NC2=CC=CC=C2N1)C(=O)CN(C)S(=O)(=O)C3=CN=CC=C3

DOS

IR

Vibrations