Geometry & MOs

Info

ID:

327488

PubChem CID:

126690079

Reduced:

FOSN8C29H35 (1)

Stoich.:

ABCD8E29F35 (1)

Weight, g/mol:

527.193729

ΔHf, kcal/mol:

50.78

Dipole, Da:

7.28

IP(EA), eV:

 -8.42(-0.65)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[[1-[2-ethyl-3-[[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-methylamino]imidazo[1,2-b]pyridazin-6-yl]piperidin-4-yl]methyl]methanesulfinamide

Drug info:

PubChemData

Smile

CCC1=C(N2C(=N1)C=CC(=N2)N3CCN(CC3)CCN4CCCC4=O)N(C)C5=NC(=CS5)C6=CCC=C(C=C6)F

DOS

IR

Vibrations