Geometry & MOs

Info

ID:	437906
PubChem CID:	135227300
Reduced:	F5N5H14C23 (1)
Stoich.:	A5B5C14D23 (1)
Weight, g/mol:	440.137257
ΔH_f, kcal/mol:	-85.59
Dipole, Da:	5.46
IP(EA), eV:	-9.43(-1.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CC1C2=C(C=CC(=C2)C3=CN4C(=NC(=C4C5=C(C6=C(C=C5)NN=C6)F)C(F)(F)F)C=N3)F

DOS

IR

Vibrations