Geometry & MOs

Info

ID:	384618
PubChem CID:	134977338
Reduced:	PS2O3C11H23 (1)
Stoich.:	AB2C3D11E23 (1)
Weight, g/mol:	282.201507
ΔH_f, kcal/mol:	-243.46
Dipole, Da:	2.07
IP(EA), eV:	-9.4(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1R,2S)-4-[tert-butyl(dimethyl)silyl]oxy-2-methylcyclohex-3-en-1-yl]propan-1-one

Drug info:

PubChemData

Smile

CCCCC(C(=O)C)SP(=S)(OCC)OCC

DOS

IR

Vibrations