Geometry & MOs

Info

ID:	300979
PubChem CID:	123058810
Reduced:	N2O6H26C29 (1)
Stoich.:	A2B6C26D29 (1)
Weight, g/mol:	530.205301
ΔH_f, kcal/mol:	-119.03
Dipole, Da:	7.97
IP(EA), eV:	-8.63(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[(3E)-2-(4-ethoxy-3-methoxyphenyl)-3-[(3-ethoxyphenyl)-hydroxymethylidene]-4,5-dioxopyrrolidin-1-yl]phenyl]acetamide

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C=C1)C2/C(=C(\C3=CC(=CC=C3)OCC)/O)/C(=O)C(=O)N2C4=CC=C(C=C4)C#N)OC

DOS

IR

Vibrations