Geometry & MOs

Info

ID:	257654
PubChem CID:	103147761
Reduced:	F2O2C13H18 (1)
Stoich.:	A2B2C13D18 (1)
Weight, g/mol:	298.099221
ΔH_f, kcal/mol:	-196.97
Dipole, Da:	2.85
IP(EA), eV:	-9.32(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2,2-difluoroethoxy)-1-[4-(trifluoromethyl)phenyl]butan-2-ol

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)C(CCOCC(F)F)O)C

DOS

IR

Vibrations