Geometry & MOs

Info

ID:	300575
PubChem CID:	122706142
Reduced:	O5C32H60 (1)
Stoich.:	A5B32C60 (1)
Weight, g/mol:	453.053463
ΔH_f, kcal/mol:	-335.24
Dipole, Da:	8.45
IP(EA), eV:	-10.32(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4Z)-5-(3,4-dichlorophenyl)-1-(2-hydroxy-5-methylphenyl)-4-[hydroxy(phenyl)methylidene]pyrrolidine-2,3-dione

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCCCCC[C@H](C[C@@H](CCC/C=C(\C)/C(=O)C(C)C(=O)O)O)O

DOS

IR

Vibrations