Geometry & MOs

Info

ID:	293305
PubChem CID:	117383769
Reduced:	FO3C14H17 (1)
Stoich.:	AB3C14D17 (1)
Weight, g/mol:	252.116173
ΔH_f, kcal/mol:	-168.6
Dipole, Da:	2.76
IP(EA), eV:	-9.05(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(6-fluoro-2-hydroxy-3-methylphenyl)cyclohexane-1-carboxylic acid

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1C2(CCCC2)C(=O)O)CF

DOS

IR

Vibrations