Geometry & MOs

Info

ID:	346210
PubChem CID:	127270701
Reduced:	N3O4C20H25 (1)
Stoich.:	A3B4C20D25 (1)
Weight, g/mol:	393.172228
ΔH_f, kcal/mol:	-157.65
Dipole, Da:	9.3
IP(EA), eV:	-9.19(-1.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-(4-methylphenyl)sulfonyl-N-(5-oxo-1-propan-2-ylpyrrolidin-3-yl)pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)C(C(=O)NC1CC(=O)N(C1)C(C)C)N2C(=O)C3=CC=CC=C3C2=O

DOS

IR

Vibrations