Geometry & MOs

Info

ID:	389726
PubChem CID:	134994747
Reduced:	PO2S2C12H23 (1)
Stoich.:	AB2C2D12E23 (1)
Weight, g/mol:	254.133821
ΔH_f, kcal/mol:	-153.43
Dipole, Da:	4.93
IP(EA), eV:	-9.08(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R)-2,10-dihydroxy-4-trimethylsilylbicyclo[3.3.2]dec-2-en-9-one

Drug info:

PubChemData

Smile

CCCOP(=S)(OCCC)SC#CC(C)(C)C

DOS

IR

Vibrations