Geometry & MOs

Info

ID:	216206
PubChem CID:	85085891
Reduced:	F3O3C11H11 (1)
Stoich.:	A3B3C11D11 (1)
Weight, g/mol:	242.073006
ΔH_f, kcal/mol:	-271.11
Dipole, Da:	8.32
IP(EA), eV:	-10.54(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-(1,1,2,2,2-pentafluoroethyl)tricyclo[3.2.1.02,4]octan-8-ol

Drug info:

PubChemData

Smile

C1CCC2C(C1)C(=O)C(=CO2)C(=O)C(F)(F)F

DOS

IR

Vibrations