Geometry & MOs

Info

ID:

307955

PubChem CID:

125310939

Reduced:

N2O4C19H20 (1)

Stoich.:

A2B4C19D20 (1)

Weight, g/mol:

538.165248

ΔHf, kcal/mol:

-108.66

Dipole, Da:

2.84

IP(EA), eV:

 -9.85(-1.44)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(1S,3R,3aR,6aS)-5-(1,3-benzodioxol-5-ylmethyl)-5'-fluoro-1-(2H-indol-3-ylmethyl)spiro[1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3,3'-1H-indole]-2',4,6-trione

Drug info:

PubChemData

Smile

COCCNC(=O)[C@@H]1C=C2C(=NC1=O)C[C@@H](CC2=O)C3=CC=CC=C3

DOS

IR

Vibrations