Geometry & MOs

Info

ID:	339117
PubChem CID:	127260496
Reduced:	ClFO2H8C13 (1)
Stoich.:	ABC2D8E13 (1)
Weight, g/mol:	268.147473
ΔH_f, kcal/mol:	-83.16
Dipole, Da:	5.4
IP(EA), eV:	-9.38(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-4-fluoro-5-hydroxyoctan-2-yl] benzoate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(=O)OC2=CC(=C(C=C2)Cl)F

DOS

IR

Vibrations