Geometry & MOs

Info

ID:

444107

PubChem CID:

135261336

Reduced:

FON7H22C32 (1)

Stoich.:

ABC7D22E32 (1)

Weight, g/mol:

436.144787

ΔHf, kcal/mol:

144.46

Dipole, Da:

10.19

IP(EA), eV:

 -8.68(-2.2)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(3Z)-3-[4-(3-fluoro-5-methoxyphenyl)pyrrolo[3,2-c]pyridin-2-ylidene]-5-pyridin-3-yl-1,2-dihydropyrazolo[3,4-c]pyridine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CC(=O)NC2=CN=CC(=C2)C3=NC=C4C(=C3)/C(=C/5\C=C6C(=N5)C=CN=C6C7=CC(=CC=C7)F)/NN4

DOS

IR

Vibrations