Geometry & MOs

Info

ID:	381199
PubChem CID:	134971855
Reduced:	OF3C14H17 (1)
Stoich.:	AB3C14D17 (1)
Weight, g/mol:	400.215078
ΔH_f, kcal/mol:	-185.08
Dipole, Da:	4.08
IP(EA), eV:	-9.41(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3aR,8R,8aS)-6-benzyl-2-phenyl-8-propyl-3a,4,5,7,8,8a-hexahydropyrrolo[3,4-f]isoindole-1,3-dione

Drug info:

PubChemData

Smile

C[C@@H](/C=C/CCOCC1=CC=CC=C1)C(F)(F)F

DOS

IR

Vibrations