Geometry & MOs

Info

ID:	225268
PubChem CID:	85753016
Reduced:	FSO4C17H29 (1)
Stoich.:	ABC4D17E29 (1)
Weight, g/mol:	455.90306
ΔH_f, kcal/mol:	-255.38
Dipole, Da:	3.86
IP(EA), eV:	-10.39(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctanoic acid

Drug info:

PubChemData

Smile

CCCCCC(CCCCO)F.CC1=CC=C(C=C1)S(=O)(=O)O

DOS

IR

Vibrations