Geometry & MOs

Info

ID:	437939
PubChem CID:	135227334
Reduced:	SF5N5H12C20 (1)
Stoich.:	AB5C5D12E20 (1)
Weight, g/mol:	439.142008
ΔH_f, kcal/mol:	-87.86
Dipole, Da:	1.41
IP(EA), eV:	-9.19(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(N2C=C(N=CC2=N1)C3=CC(=C(C=C3)F)S(F)(F)F)C4=C(C5=C(C=C4)NN=C5)F

DOS

IR

Vibrations