Geometry & MOs

Info

ID:

444195

PubChem CID:

135261661

Reduced:

FON8C35H37 (1)

Stoich.:

ABC8D35E37 (1)

Weight, g/mol:

465.160103

ΔHf, kcal/mol:

105.86

Dipole, Da:

7.76

IP(EA), eV:

 -8.31(-1.73)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(3Z)-3-[4-(3-fluoro-5-methoxyphenyl)indol-2-ylidene]-5-(5-methoxypyridin-3-yl)-1,2-dihydropyrazolo[3,4-b]pyridine

Drug info:

PubChemData

Smile

CN(C)CCNC1=CC(=CC(=C1)C2=CC=CC3=N/C(=C\4/C5=C(NN4)N=CC(=C5)C6=CC(=CN=C6)OCCN7CCCC7)/C=C32)F

DOS

IR

Vibrations