Geometry & MOs

Info

ID:	294221
PubChem CID:	117438459
Reduced:	SO5C12H18 (1)
Stoich.:	AB5C12D18 (1)
Weight, g/mol:	274.087495
ΔH_f, kcal/mol:	-203.14
Dipole, Da:	5.57
IP(EA), eV:	-9.18(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,3-dimethoxy-4-methylsulfonylphenyl)propan-2-ol

Drug info:

PubChemData

Smile

CC(CC1=C(C=CC(=C1S(=O)(=O)C)OC)OC)O

DOS

IR

Vibrations