Geometry & MOs

Info

ID:	354963
PubChem CID:	127287824
Reduced:	SN2O2C11H14 (1)
Stoich.:	AB2C2D11E14 (1)
Weight, g/mol:	301.142641
ΔH_f, kcal/mol:	-72.72
Dipole, Da:	6.1
IP(EA), eV:	-9.17(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-5-oxo-N-[3-(pyrrolidine-1-carbonyl)phenyl]pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(SC=C1)CNC(=O)[C@H]2CCC(=O)N2

DOS

IR

Vibrations