Geometry & MOs

Info

ID:	225267
PubChem CID:	85753015
Reduced:	Cl3O3C4H5 (1)
Stoich.:	A3B3C4D5 (1)
Weight, g/mol:	348.177059
ΔH_f, kcal/mol:	-158.94
Dipole, Da:	3.26
IP(EA), eV:	-11.08(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-fluorodecan-1-ol;4-methylbenzenesulfonic acid

Drug info:

PubChemData

Smile

C(C(C(=O)O)O)C(Cl)(Cl)Cl

DOS

IR

Vibrations