Geometry & MOs

Info

ID:	339007
PubChem CID:	127260018
Reduced:	SO4H14C17 (1)
Stoich.:	AB4C14D17 (1)
Weight, g/mol:	306.056195
ΔH_f, kcal/mol:	-94.04
Dipole, Da:	4.64
IP(EA), eV:	-8.32(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(4-methoxyphenyl)-2-oxoethyl] benzenesulfonate

Drug info:

PubChemData

Smile

COC1=CC(=CC2=CC=CC=C21)OS(=O)(=O)C3=CC=CC=C3

DOS

IR

Vibrations