Geometry & MOs

Info

ID:

199008

PubChem CID:

79187072

Reduced:

ClFNSO2C12H17 (1)

Stoich.:

ABCDE2F12G17 (1)

Weight, g/mol:

340.995856

ΔHf, kcal/mol:

-127.97

Dipole, Da:

5.47

IP(EA), eV:

-9.33(-1.09)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

4-[4-(chloromethyl)-2-fluorophenyl]sulfonyl-1,4-thiazinane 1,1-dioxide

Drug info:

PubChemData

Smile

CCC(C)N(C)S(=O)(=O)C1=C(C=C(C=C1)CCl)F

DOS

IR

Vibrations