Geometry & MOs

Info

ID:	72312
PubChem CID:	48416033
Reduced:	SN4O4C17H20 (1)
Stoich.:	AB4C4D17E20 (1)
Weight, g/mol:	418.236876
ΔH_f, kcal/mol:	-74.92
Dipole, Da:	4.37
IP(EA), eV:	-9.12(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(1H-benzimidazol-2-yl)propyl]-3-(cyclohexanecarbonylamino)-N-methylbenzamide

Drug info:

PubChemData

Smile

CNS(=O)(=O)C1=CC=C(O1)C(=O)N(C)CCCC2=NC3=CC=CC=C3N2

DOS

IR

Vibrations