Geometry & MOs

Info

ID:	816
PubChem CID:	3392
Reduced:	FO6C24H33 (1)
Stoich.:	AB6C24D33 (1)
Weight, g/mol:	436.226117
ΔH_f, kcal/mol:	-333.95
Dipole, Da:	7.87
IP(EA), eV:	-9.89(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

19-fluoro-11-hydroxy-8-(2-hydroxyacetyl)-6,6,9,13-tetramethyl-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icos-17-en-16-one

Drug info:

PubChemData

Smile

CC1(OC2CC3C4CC(C5=CC(=O)CCC5(C4C(CC3(C2(O1)C(=O)CO)C)O)C)F)C

DOS

IR

Vibrations