Geometry & MOs

Info

ID:

301016

PubChem CID:

123059374

Reduced:

FNO6C31H32 (1)

Stoich.:

ABC6D31E32 (1)

Weight, g/mol:

543.262088

ΔHf, kcal/mol:

-216.7

Dipole, Da:

8.07

IP(EA), eV:

 -8.59(-1.19)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(4Z)-1-(3,5-dimethylphenyl)-4-[hydroxy-[3-(2-methylpropoxy)phenyl]methylidene]-5-(4-methoxy-3-propoxyphenyl)pyrrolidine-2,3-dione

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C=C1)C2/C(=C(\C3=CC(=CC=C3)OCC(C)C)/O)/C(=O)C(=O)N2C4=CC=C(C=C4)F)OCC

DOS

IR

Vibrations