Geometry & MOs

Info

ID:	72175
PubChem CID:	48415891
Reduced:	ON4C17H18 (1)
Stoich.:	AB4C17D18 (1)
Weight, g/mol:	355.135448
ΔH_f, kcal/mol:	30.38
Dipole, Da:	2.66
IP(EA), eV:	-9.13(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations