Geometry & MOs

Info

ID:	269229
PubChem CID:	103616451
Reduced:	ClSO3C11H15 (1)
Stoich.:	ABC3D11E15 (1)
Weight, g/mol:	242.097666
ΔH_f, kcal/mol:	-122.34
Dipole, Da:	4.13
IP(EA), eV:	-9.06(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-4-(2-propylsulfonylethoxy)benzene

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations