Geometry & MOs

Info

ID:	133419
PubChem CID:	51524867
Reduced:	N2O3H9C14 (1)
Stoich.:	A2B3C9D14 (1)
Weight, g/mol:	454.085098
ΔH_f, kcal/mol:	16.99
Dipole, Da:	1.37
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 1.431551
Charge, e:	0

Chem-info

IUPAC name:

(5S)-1-(4-chlorophenyl)-3-(4-chlorophenyl)imino-5-(3,4-dimethoxyphenyl)pyrrolidin-2-one

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N=CC2=C(OC(=N2)C3=CC=CO3)[O-]

DOS

IR

Vibrations