Geometry & MOs

Info

ID:	437954
PubChem CID:	135227349
Reduced:	OF3N3H20C24 (1)
Stoich.:	AB3C3D20E24 (1)
Weight, g/mol:	429.176502
ΔH_f, kcal/mol:	-47.46
Dipole, Da:	15.58
IP(EA), eV:	-8.02(-2.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopropyl-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(=CN2)N=C(C3=C4C(=CC(=O)C=C4F)F)C5CC5)F

DOS

IR

Vibrations