Geometry & MOs

Info

ID:	318006
PubChem CID:	126648326
Reduced:	SF3O4C15H15 (1)
Stoich.:	AB3C4D15E15 (1)
Weight, g/mol:	322.156895
ΔH_f, kcal/mol:	-299.12
Dipole, Da:	2.64
IP(EA), eV:	-9.85(-1.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

20-oxatetracyclo[10.10.0.02,10.05,9]docosa-2(10),3,5,7,11-pentaene-13,21-dione

Drug info:

PubChemData

Smile

CC(=O)C1=CC2=C(C3CCC2CC3)C(=C1)OS(=O)(=O)C(F)(F)F

DOS

IR

Vibrations