Geometry & MOs

Info

ID:	300598
PubChem CID:	123044740
Reduced:	NO6C30H31 (1)
Stoich.:	AB6C30D31 (1)
Weight, g/mol:	523.131714
ΔH_f, kcal/mol:	-164.83
Dipole, Da:	6.5
IP(EA), eV:	-8.6(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4E)-5-(3,4-dichlorophenyl)-1-(2,3-dimethylphenyl)-4-[hydroxy-[3-(2-methylpropoxy)phenyl]methylidene]pyrrolidine-2,3-dione

Drug info:

PubChemData

Smile

CCCOC1=CC=CC(=C1)C2/C(=C(/C3=CC(=CC=C3)OCC)\O)/C(=O)C(=O)N2C4=CC(=CC=C4)OCC

DOS

IR

Vibrations