Geometry & MOs

Info

ID:

85677

PubChem CID:

49878020

Reduced:

FN2O5C25H25 (1)

Stoich.:

AB2C5D25E25 (1)

Weight, g/mol:

450.1591

ΔHf, kcal/mol:

-191.69

Dipole, Da:

8.04

IP(EA), eV:

 -8.97(-1.09)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(4'Z)-4'-[(3-fluoro-4-methylphenyl)-hydroxymethylidene]-1'-(2-methoxyethyl)-1-prop-2-enylspiro[indole-3,5'-pyrrolidine]-2,2',3'-trione

Drug info:

PubChemData

Smile

CCN1C2=CC=CC=C2C3(C1=O)/C(=C(\C4=CC(=C(C=C4)C)F)/O)/C(=O)C(=O)N3CCCOC

DOS

IR

Vibrations