Geometry & MOs

Info

ID:	300804
PubChem CID:	123055056
Reduced:	NO6C31H31 (1)
Stoich.:	AB6C31D31 (1)
Weight, g/mol:	520.166808
ΔH_f, kcal/mol:	-180.65
Dipole, Da:	6.93
IP(EA), eV:	-8.97(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(3E)-2-(4-ethylphenyl)-3-[hydroxy-(4-propan-2-yloxyphenyl)methylidene]-4,5-dioxopyrrolidin-1-yl]benzenesulfonamide

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)C2/C(=C(/C3=CC=C(C=C3)OC(C)C)\O)/C(=O)C(=O)N2C4=CC=CC(=C4)C(=O)OCC

DOS

IR

Vibrations