Geometry & MOs

Info

ID:	270366
PubChem CID:	103636267
Reduced:	ClO2F3C11H12 (1)
Stoich.:	AB2C3D11E12 (1)
Weight, g/mol:	266.092992
ΔH_f, kcal/mol:	-242.07
Dipole, Da:	2.9
IP(EA), eV:	-9.78(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-fluoro-2-methylphenyl)-3-(2,2,2-trifluoroethoxy)propan-1-ol

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations