Geometry & MOs

Info

ID:	407641
PubChem CID:	135080391
Reduced:	FN2O2H11C12 (1)
Stoich.:	AB2C2D11E12 (1)
Weight, g/mol:	230.046711
ΔH_f, kcal/mol:	-68.6
Dipole, Da:	1.77
IP(EA), eV:	-9.77(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-fluoro-5-[4-(trifluoromethyl)phenyl]-1H-pyrazole

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC=C(C=C1)C2=C(C=NN2)F

DOS

IR

Vibrations