Geometry & MOs

Info

ID:	23866
PubChem CID:	606888
Reduced:	H2F3C4 (2)
Stoich.:	A2B3C4 (2)
Weight, g/mol:	214.021719
ΔH_f, kcal/mol:	-300.29
Dipole, Da:	0.15
IP(EA), eV:	-10.87(-1.39)
Spin(S_z, S²):	None, None
Charge, e:	-6

Chem-info

IUPAC name:

1,4-bis(trifluoromethyl)cyclohexane

Drug info:

PubChemData

Smile

[CH-]1[CH-][C-]([CH-][CH-][C-]1C(F)(F)F)C(F)(F)F

DOS

IR

Vibrations