Geometry & MOs

Info

ID:	437904
PubChem CID:	135227298
Reduced:	N5F7H14C24 (1)
Stoich.:	A5B7C14D24 (1)
Weight, g/mol:	455.136923
ΔH_f, kcal/mol:	-177.95
Dipole, Da:	4.24
IP(EA), eV:	-9.09(-1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-fluoro-1H-indazol-5-yl)-6-(3-propan-2-yloxyphenyl)-2-(trifluoromethyl)imidazo[1,2-a]pyrazine

Drug info:

PubChemData

Smile

C1CC1C2=NN3C=NC(=CC3=C2C4=C(C5=C(C=C4)NN=C5)F)C6=CC(=C(C=C6)F)C(C(F)(F)F)(F)F

DOS

IR

Vibrations