Geometry & MOs

Info

ID:	270357
PubChem CID:	103636230
Reduced:	OF3C6H6 (2)
Stoich.:	AB3C6D6 (2)
Weight, g/mol:	248.102414
ΔH_f, kcal/mol:	-394.8
Dipole, Da:	1.71
IP(EA), eV:	-10.36(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-phenyl-4-(2,2,2-trifluoroethoxy)butan-2-ol

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations