Geometry & MOs

Info

ID:	217872
PubChem CID:	85088519
Reduced:	SO4F5H13C17 (1)
Stoich.:	AB4C5D13E17 (1)
Weight, g/mol:	408.09815
ΔH_f, kcal/mol:	-287.53
Dipole, Da:	2.27
IP(EA), eV:	-9.7(-1.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[iodo(trimethylsilyl)methylidene]-4-[(2-methylpropan-2-yl)oxy]oct-7-en-3-one

Drug info:

PubChemData

Smile

CC1C(O1)C2C3C2(C(=O)CC3)COC(=S)OC4=C(C(=C(C(=C4F)F)F)F)F

DOS

IR

Vibrations