Geometry & MOs

Info

ID:	233380
PubChem CID:	89854496
Reduced:	SO5C10H14 (1)
Stoich.:	AB5C10D14 (1)
Weight, g/mol:	331.084458
ΔH_f, kcal/mol:	-197.08
Dipole, Da:	5.33
IP(EA), eV:	-9.03(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4-bis(4-hydroxyphenyl)isoindole-1,3-dione

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)S(=O)O)OC(C(C)O)O

DOS

IR

Vibrations