Geometry & MOs

Info

ID:	72301
PubChem CID:	48416021
Reduced:	OF2N3C20H21 (1)
Stoich.:	AB2C3D20E21 (1)
Weight, g/mol:	418.236876
ΔH_f, kcal/mol:	-85.76
Dipole, Da:	4.54
IP(EA), eV:	-9.18(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN(CCCC1=NC2=CC=CC=C2N1)C(=O)CCC3=CC(=C(C=C3)F)F

DOS

IR

Vibrations