Geometry & MOs

Info

ID:	300999
PubChem CID:	123058997
Reduced:	NO3C16H16 (2)
Stoich.:	AB3C16D16 (2)
Weight, g/mol:	522.146072
ΔH_f, kcal/mol:	-135.33
Dipole, Da:	10.77
IP(EA), eV:	-8.73(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(3E)-2-(3-ethoxyphenyl)-3-[(3-ethoxyphenyl)-hydroxymethylidene]-4,5-dioxopyrrolidin-1-yl]benzenesulfonamide

Drug info:

PubChemData

Smile

CCCCOC1=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)OCC

DOS

IR

Vibrations