Geometry & MOs

Info

ID:	300635
PubChem CID:	123046613
Reduced:	NO8C31H31 (1)
Stoich.:	AB8C31D31 (1)
Weight, g/mol:	509.164994
ΔH_f, kcal/mol:	-239.06
Dipole, Da:	6.25
IP(EA), eV:	-8.67(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4E)-1-(2,5-difluorophenyl)-4-[(2,5-dimethoxyphenyl)-hydroxymethylidene]-5-(3-propoxyphenyl)pyrrolidine-2,3-dione

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations