Geometry & MOs

Info

ID:	339011
PubChem CID:	127260022
Reduced:	SO4F5H7C13 (1)
Stoich.:	AB4C5D7E13 (1)
Weight, g/mol:	278.06128
ΔH_f, kcal/mol:	-325.07
Dipole, Da:	6.84
IP(EA), eV:	-9.61(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-methoxyphenyl)methyl benzenesulfonate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)S(=O)(=O)OC2=C(C(=C(C(=C2F)F)OCF)F)F

DOS

IR

Vibrations