Geometry & MOs

Info

ID:

447916

PubChem CID:

135286771

Reduced:

FON8H25C29 (1)

Stoich.:

ABC8D25E29 (1)

Weight, g/mol:

447.191992

ΔHf, kcal/mol:

135.43

Dipole, Da:

4.91

IP(EA), eV:

 -8.87(-2.18)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N,N-dimethyl-1-[5-[(3Z)-3-(7-pyridin-4-ylimidazo[4,5-c]pyridin-2-ylidene)-1,2-dihydropyrazolo[4,3-b]pyridin-5-yl]pyridin-3-yl]methanamine

Drug info:

PubChemData

Smile

C1CCN(C1)CCOC2=CC(=CC(=C2)C3=CN=CC4=N/C(=C/5\C6=CC(=NC=C6NN5)C7=NC=CN=C7)/C=C34)F

DOS

IR

Vibrations