Geometry & MOs

Info

ID:	236008
PubChem CID:	92711344
Reduced:	SN2O2C16H16 (1)
Stoich.:	AB2C2D16E16 (1)
Weight, g/mol:	286.168128
ΔH_f, kcal/mol:	-35.69
Dipole, Da:	1.93
IP(EA), eV:	-8.95(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-N-cyclohexyl-2-oxo-1-phenylpyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

C1CN(C(=O)[C@H]1C(=O)NCC2=CC=CS2)C3=CC=CC=C3

DOS

IR

Vibrations