Geometry & MOs

Info

ID:

327395

PubChem CID:

126689786

Reduced:

FO2S2N7C25H28 (1)

Stoich.:

AB2C2D7E25F28 (1)

Weight, g/mol:

560.167574

ΔHf, kcal/mol:

1.8

Dipole, Da:

6.27

IP(EA), eV:

 -8.59(-1.03)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

3-[3-[[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-methylamino]-6-(1-methylsulfonylpiperidin-4-yl)imidazo[1,2-b]pyridazin-2-yl]propane-1,1-diol

Drug info:

PubChemData

Smile

CN(C1=C(N=C2N1N=C(C=C2)C3CCN(CC3)S(=O)C)CCC(=O)N)C4=NC(=CS4)C5=CC=C(C=C5)F

DOS

IR

Vibrations