Geometry & MOs

Info

ID:	238636
PubChem CID:	92763998
Reduced:	SN2O2C20H20 (1)
Stoich.:	AB2C2D20E20 (1)
Weight, g/mol:	376.064841
ΔH_f, kcal/mol:	-20.29
Dipole, Da:	8.7
IP(EA), eV:	-9.34(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-3-(4-aminophenyl)sulfanyl-1-(4-chloro-2-methoxy-5-methylphenyl)pyrrolidine-2,5-dione

Drug info:

PubChemData

Smile

C1CCCC2=NC(=C(C=C2CC1)C#N)S[C@H](C3=CC=CC=C3)C(=O)O

DOS

IR

Vibrations