Geometry & MOs

Info

ID:	412970
PubChem CID:	135085908
Reduced:	KO3F4C5H5 (1)
Stoich.:	AB3C4D5E5 (1)
Weight, g/mol:	340.207216
ΔH_f, kcal/mol:	-393.44
Dipole, Da:	15.07
IP(EA), eV:	-9.16(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tridecan-2-yl benzenesulfonate

Drug info:

PubChemData

Smile

CCOC(C(=O)[O-])(C(F)(F)F)F.[K+]

DOS

IR

Vibrations