Geometry & MOs

Info

ID:	312731
PubChem CID:	126607601
Reduced:	FON8C24H27 (1)
Stoich.:	ABC8D24E27 (1)
Weight, g/mol:	430.155352
ΔH_f, kcal/mol:	48.55
Dipole, Da:	9.52
IP(EA), eV:	-8.93(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,6-dimethoxypyridin-3-yl)-6-[3-(4-fluorophenyl)-1-methylpyrazol-4-yl]imidazo[1,2-b]pyridazine

Drug info:

PubChemData

Smile

CN1C(=C(C(=N1)C2=CC=C(C=C2)F)C3=NN4C=C(N=C4C=C3)NC=O)C5CCN(CC5)CCN

DOS

IR

Vibrations