Geometry & MOs

Info

ID:

308909

PubChem CID:

126531836

Reduced:

N8H22C23 (1)

Stoich.:

A8B22C23 (1)

Weight, g/mol:

550.271719

ΔHf, kcal/mol:

197.97

Dipole, Da:

8.37

IP(EA), eV:

 -8.3(-1.98)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[3-fluoro-5-[(2Z)-2-[5-[5-(propan-2-ylamino)pyridin-3-yl]-1,2-dihydropyrazolo[4,3-b]pyridin-3-ylidene]imidazo[4,5-c]pyridin-4-yl]phenyl]-N',N'-dimethylethane-1,2-diamine

Drug info:

PubChemData

Smile

CN1CCN(CC1)C2=NC=CC3=N/C(=C/4\C5=C(C=CC(=N5)C6=CC=NC=C6)NN4)/C=C32

DOS

IR

Vibrations