Geometry & MOs

Info

ID:	356910
PubChem CID:	127292518
Reduced:	O2N5C20H27 (1)
Stoich.:	A2B5C20D27 (1)
Weight, g/mol:	389.221561
ΔH_f, kcal/mol:	-18.72
Dipole, Da:	4.98
IP(EA), eV:	-8.22(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(1H-benzimidazol-2-yl)-N-(1-phenylpyrrolidin-3-yl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=NC(=NO1)CC2CCCN(C2)C(=O)NC3CCN(C3)C4=CC=CC=C4

DOS

IR

Vibrations