Geometry & MOs

Info

ID:

309049

PubChem CID:

126535435

Reduced:

FON8H23C28 (1)

Stoich.:

ABC8D23E28 (1)

Weight, g/mol:

476.170922

ΔHf, kcal/mol:

123.26

Dipole, Da:

10.84

IP(EA), eV:

 -8.57(-2.17)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

5-[(3Z)-3-[7-(1,3-benzodioxol-5-yl)imidazo[4,5-b]pyridin-2-ylidene]-1,2-dihydropyrazolo[4,3-b]pyridin-5-yl]-N,N-dimethylpyridin-3-amine

Drug info:

PubChemData

Smile

CC(C)(C)C(=O)NC1=CN=CC(=C1)C2=NC\3=C(C=C2)NN/C3=C\4/N=C5C(=CC=NC5=N4)C6=CC(=CC=C6)F

DOS

IR

Vibrations