Geometry & MOs

Info

ID:	366404
PubChem CID:	127319885
Reduced:	N2O2C9H11 (2)
Stoich.:	A2B2C9D11 (2)
Weight, g/mol:	398.142405
ΔH_f, kcal/mol:	-143.61
Dipole, Da:	8.11
IP(EA), eV:	-9.37(-1.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)C(C(=O)NC1CCN(C1)C(=O)N)N2C(=O)C3=CC=CC=C3C2=O

DOS

IR

Vibrations