Geometry & MOs

Info

ID:	437952
PubChem CID:	135227347
Reduced:	F2N5H23C25 (1)
Stoich.:	A2B5C23D25 (1)
Weight, g/mol:	443.192152
ΔH_f, kcal/mol:	24.32
Dipole, Da:	4.93
IP(EA), eV:	-8.97(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)C1=C(C=CC(=C1)C2=CN3C(=NC(=C3C4=C(C5=C(C=C4)NN=C5)F)C(C)C)C=N2)F

DOS

IR

Vibrations