Geometry & MOs

Info

ID:	339025
PubChem CID:	127260036
Reduced:	SO6H12C14 (1)
Stoich.:	AB6C12D14 (1)
Weight, g/mol:	368.238516
ΔH_f, kcal/mol:	-189.27
Dipole, Da:	6.24
IP(EA), eV:	-9.83(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyltetradecan-2-yl benzenesulfonate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(=O)C(O)OC2=CC=CC=C2S(=O)(=O)O

DOS

IR

Vibrations