Geometry & MOs

Info

ID:	204939
PubChem CID:	80035121
Reduced:	OF4C12H12 (1)
Stoich.:	AB4C12D12 (1)
Weight, g/mol:	288.088576
ΔH_f, kcal/mol:	-223.06
Dipole, Da:	3.66
IP(EA), eV:	-10.35(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-ethylpyrazol-3-yl)-[2-fluoro-3-(trifluoromethyl)phenyl]methanol

Drug info:

PubChemData

Smile

C1CC1CC(C2=C(C(=CC=C2)C(F)(F)F)F)O

DOS

IR

Vibrations