Geometry & MOs

Info

ID:	244599
PubChem CID:	99368160
Reduced:	SCl2O3N4C21H24 (1)
Stoich.:	AB2C3D4E21F24 (1)
Weight, g/mol:	380.184841
ΔH_f, kcal/mol:	-94.52
Dipole, Da:	5.62
IP(EA), eV:	-8.61(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-1-(4-methylphenyl)-N-[2-[methyl(pyridin-3-ylmethyl)amino]-2-oxoethyl]-5-oxopyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CN(CC1=CN=CC=C1)C(=O)CNC(=O)[C@H](CCSC)NC(=O)C2=C(C=C(C=C2)Cl)Cl

DOS

IR

Vibrations