Geometry & MOs

Info

ID:	397623
PubChem CID:	135030484
Reduced:	SO3C15H22 (1)
Stoich.:	AB3C15D22 (1)
Weight, g/mol:	415.086076
ΔH_f, kcal/mol:	-116.62
Dipole, Da:	2.73
IP(EA), eV:	-8.35(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

[2-[[(2S)-oxan-2-yl]oxymethyl]phenyl]-propan-2-yl-(trifluoromethylsulfonyloxy)sulfanium

Drug info:

PubChemData

Smile

CC(C)S(=O)C1=CC=CC=C1CO[C@H]2CCCCO2

DOS

IR

Vibrations