Geometry & MOs

Info

ID:	441119
PubChem CID:	135233172
Reduced:	SF2N6H12C20 (1)
Stoich.:	AB2C6D12E20 (1)
Weight, g/mol:	383.130614
ΔH_f, kcal/mol:	86.48
Dipole, Da:	5.59
IP(EA), eV:	-8.98(-1.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[3-(2,2-difluoroethyl)-5-(6-methylpyridin-2-yl)imidazol-4-yl]imidazo[1,2-b]pyridazine-3-carboxamide

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C=C(S2)C3=C(N(C=N3)CC(F)F)C4=NN5C(=NC=C5C#N)C=C4

DOS

IR

Vibrations