Geometry & MOs

Info

ID:

229913

PubChem CID:

87569497

Reduced:

ON2C38H78 (1)

Stoich.:

AB2C38D78 (1)

Weight, g/mol:

1236.978533

ΔHf, kcal/mol:

-215.08

Dipole, Da:

4.31

IP(EA), eV:

-9.07(1.28)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

3-(4-cyclohexylphenoxy)sulfonyl-1,1,2,2,3,3-hexafluoropropane-1-sulfonic acid;1,1,2,2,3,3-hexafluoro-3-phenoxysulfonylpropane-1-sulfonic acid;1,1,2,2,3,3-hexafluoro-3-piperidin-1-ylsulfonylpropane-1-sulfonic acid

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCCCC)CC(=O)N

DOS

IR

Vibrations