Geometry & MOs

Info

ID:	269230
PubChem CID:	103616452
Reduced:	SO3C12H18 (1)
Stoich.:	AB3C12D18 (1)
Weight, g/mol:	242.097666
ΔH_f, kcal/mol:	-121.59
Dipole, Da:	4.79
IP(EA), eV:	-8.72(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-3-(2-propylsulfonylethoxy)benzene

Drug info:

PubChemData

Smile

CCCS(=O)(=O)CCOC1=CC=C(C=C1)C

DOS

IR

Vibrations