Geometry & MOs

Info

ID:	304801
PubChem CID:	124766187
Reduced:	FN2O4C19H23 (1)
Stoich.:	AB2C4D19E23 (1)
Weight, g/mol:	452.173607
ΔH_f, kcal/mol:	-216.08
Dipole, Da:	1.31
IP(EA), eV:	-9.75(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3aR,7aR)-2-[4-[4-[(3aR,7aR)-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl]phenyl]phenyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione

Drug info:

PubChemData

Smile

CC[C@@]1([C@H]2[C@@H]([C@H](N1)C3=CC(=CC=C3)F)C(=O)N(C2=O)CC)C(=O)OCC

DOS

IR

Vibrations