Geometry & MOs

Info

ID:

338998

PubChem CID:

127260009

Reduced:

SO3C15H18 (1)

Stoich.:

AB3C15D18 (1)

Weight, g/mol:

266.097666

ΔHf, kcal/mol:

-85.94

Dipole, Da:

4.01

IP(EA), eV:

-9.21(-0.76)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

(4-ethenylcyclohexyl) benzenesulfonate

Drug info:

PubChemData

Smile

C=CC1=CCC(CC1)COS(=O)(=O)C2=CC=CC=C2

DOS

IR

Vibrations