Geometry & MOs

Info

ID:

448215

PubChem CID:

135289319

Reduced:

FSO2N7H28C30 (1)

Stoich.:

ABC2D7E28F30 (1)

Weight, g/mol:

396.155941

ΔHf, kcal/mol:

64.58

Dipole, Da:

12.8

IP(EA), eV:

 -8.52(-1.98)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(2Z)-7-(4-methylimidazol-1-yl)-2-[5-(1-methylpyrazol-4-yl)-1,2-dihydropyrazolo[4,3-b]pyridin-3-ylidene]imidazo[4,5-b]pyridine

Drug info:

PubChemData

Smile

CN(C)CC1=CC(=CN=C1)C2=CC\3=C(C=C2)NN/C3=C\4/C=C5C(=N4)C=CN=C5C6=CC(=CC(=C6)CNS(=O)(=O)C)F

DOS

IR

Vibrations