Geometry & MOs

Info

ID:	262727
PubChem CID:	103312508
Reduced:	OF3H3C4 (2)
Stoich.:	AB3C3D4 (2)
Weight, g/mol:	278.110534
ΔH_f, kcal/mol:	-376.43
Dipole, Da:	3.52
IP(EA), eV:	-10.03(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,3,3-trifluoro-1-(4-methylcyclohexyl)-2-(trifluoromethyl)propan-1-ol

Drug info:

PubChemData

Smile

C1=COC(=C1)C(C(C(F)(F)F)C(F)(F)F)O

DOS

IR

Vibrations