Geometry & MOs

Info

ID:	160894
PubChem CID:	57390155
Reduced:	OF3H5C7 (2)
Stoich.:	AB3C5D7 (2)
Weight, g/mol:	479.267173
ΔH_f, kcal/mol:	-386.49
Dipole, Da:	1.42
IP(EA), eV:	-10.71(-1.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1S,2R,3S,4S,6R,7R,8R,14R)-4-ethenyl-3-hydroxy-2,4,7,14-tetramethyl-9-oxo-6-tricyclo[5.4.3.01,8]tetradecanyl] 3-oxo-1H-isoindole-2-carboxylate

Drug info:

PubChemData

Smile

C1C(CC(=O)CC1=O)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

DOS

IR

Vibrations