Geometry & MOs

Info

ID:	197595
PubChem CID:	78981612
Reduced:	NOC8H11 (2)
Stoich.:	ABC8D11 (2)
Weight, g/mol:	276.093249
ΔH_f, kcal/mol:	-90.11
Dipole, Da:	4.2
IP(EA), eV:	-9.81(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-oxo-N-(2-prop-2-enylsulfanylphenyl)pyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)CC(C1=CC=CC=C1)NC(=O)C2CC(=O)NC2

DOS

IR

Vibrations