Geometry & MOs

Info

ID:	339506
PubChem CID:	127261439
Reduced:	SO3C18H18 (1)
Stoich.:	AB3C18D18 (1)
Weight, g/mol:	240.082016
ΔH_f, kcal/mol:	-65.6
Dipole, Da:	5.69
IP(EA), eV:	-9.15(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S,4S)-3-methyl-4-(4-methylphenyl)sulfonyloxolane

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)C\2COC/C2=C/C3=CC=CC=C3

DOS

IR

Vibrations