Geometry & MOs

Info

ID:	339501
PubChem CID:	127261434
Reduced:	SO3C13H18 (1)
Stoich.:	AB3C13D18 (1)
Weight, g/mol:	254.097666
ΔH_f, kcal/mol:	-116.18
Dipole, Da:	5.33
IP(EA), eV:	-9.78(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S,4R)-3-ethyl-4-(4-methylphenyl)sulfonyloxolane

Drug info:

PubChemData

Smile

CC[C@H]1COC[C@H]1S(=O)(=O)C2=CC=C(C=C2)C

DOS

IR

Vibrations