Geometry & MOs

Info

ID:	178750
PubChem CID:	76376095
Reduced:	Cl2F3O3C16H17 (1)
Stoich.:	A2B3C3D16E17 (1)
Weight, g/mol:	324.23006
ΔH_f, kcal/mol:	-286.71
Dipole, Da:	3.74
IP(EA), eV:	-9.92(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2'-hydroxyspiro[1,3-dioxolane-2,5'-2,3,3a,4,6,6a-hexahydro-1H-pentalene]-1'-yl)-4-methyloctan-1-one

Drug info:

PubChemData

Smile

CC1=C(C(=O)CC1OC(=O)C2C(C2(C)C)C=C(Cl)Cl)CC(F)(F)F

DOS

IR

Vibrations