Geometry & MOs

Info

ID:	366401
PubChem CID:	127319882
Reduced:	NOC4H5 (4)
Stoich.:	ABC4D5 (4)
Weight, g/mol:	394.167477
ΔH_f, kcal/mol:	-146.86
Dipole, Da:	3.41
IP(EA), eV:	-8.87(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-carbamoylpyrrolidin-3-yl)-1-(4-methylphenyl)sulfonylpiperidine-4-carboxamide

Drug info:

PubChemData

Smile

C1CN(CC1NC(=O)CCN2C(=O)COC3=CC=CC=C32)C(=O)N

DOS

IR

Vibrations