Geometry & MOs

Info

ID:	300986
PubChem CID:	123058860
Reduced:	NO6C31H33 (1)
Stoich.:	AB6C31D33 (1)
Weight, g/mol:	515.230788
ΔH_f, kcal/mol:	-168.31
Dipole, Da:	6.98
IP(EA), eV:	-8.36(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4Z)-5-(3,4-diethoxyphenyl)-1-(2,5-dimethylphenyl)-4-[(3-ethoxyphenyl)-hydroxymethylidene]pyrrolidine-2,3-dione

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)N2C(/C(=C(\C3=CC(=CC=C3)OCC)/O)/C(=O)C2=O)C4=CC(=C(C=C4)OCC)OCC

DOS

IR

Vibrations