Geometry & MOs

Info

ID:	381581
PubChem CID:	134972362
Reduced:	OF3H9C10 (1)
Stoich.:	AB3C9D10 (1)
Weight, g/mol:	288.172545
ΔH_f, kcal/mol:	-113.92
Dipole, Da:	3.22
IP(EA), eV:	-9.81(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,8S,9R,12S)-1-propan-2-yloxy-9-propyl-10,13-dioxatetracyclo[9.2.1.02,7.08,12]tetradeca-2,4,6-triene

Drug info:

PubChemData

Smile

C1C2C=CC1C3C2C(=CO3)C(F)(F)F

DOS

IR

Vibrations