Geometry & MOs

Info

ID:	260940
PubChem CID:	103210365
Reduced:	BrO2F3C11H12 (1)
Stoich.:	AB2C3D11E12 (1)
Weight, g/mol:	304.165014
ΔH_f, kcal/mol:	-219.5
Dipole, Da:	1.92
IP(EA), eV:	-9.88(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,4,6-triethylphenyl)-2-(2,2,2-trifluoroethoxy)ethanol

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1C(CCOCC(F)F)O)Br)F

DOS

IR

Vibrations