Geometry & MOs

Info

ID:	315161
PubChem CID:	126624706
Reduced:	FN2C9H9 (1)
Stoich.:	AB2C9D9 (1)
Weight, g/mol:	242.103083
ΔH_f, kcal/mol:	-3.57
Dipole, Da:	0.82
IP(EA), eV:	-9.11(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-butan-2-yl-6-(trifluoromethyl)-2H-indazole

Drug info:

PubChemData

Smile

CCC1=C2C=NNC2=CC(=C1)F

DOS

IR

Vibrations