Geometry & MOs

Info

ID:	72271
PubChem CID:	48415991
Reduced:	OSN4C16H18 (1)
Stoich.:	ABC4D16E18 (1)
Weight, g/mol:	389.155098
ΔH_f, kcal/mol:	26.86
Dipole, Da:	3.29
IP(EA), eV:	-9.07(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(1H-benzimidazol-2-yl)propyl]-3-(difluoromethoxy)-4-methoxy-N-methylbenzamide

Drug info:

PubChemData

Smile

CC1=C(SC=N1)C(=O)N(C)CCCC2=NC3=CC=CC=C3N2

DOS

IR

Vibrations