Geometry & MOs

Info

ID:	233907
PubChem CID:	92192361
Reduced:	ClN2O4C22H23 (1)
Stoich.:	AB2C4D22E23 (1)
Weight, g/mol:	370.144806
ΔH_f, kcal/mol:	-135.21
Dipole, Da:	1.24
IP(EA), eV:	-8.76(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-[(2-chlorophenyl)methyl]-N-[2-(3-methylphenyl)ethyl]-5-oxopyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

C[C@@H](C1=CC2=C(C=C1)OCCO2)NC(=O)[C@@H]3CCC(=O)N3CC4=CC=CC=C4Cl

DOS

IR

Vibrations