Geometry & MOs

Info

ID:	446199
PubChem CID:	135273074
Reduced:	N7H21C26 (1)
Stoich.:	A7B21C26 (1)
Weight, g/mol:	433.170274
ΔH_f, kcal/mol:	212.04
Dipole, Da:	2.65
IP(EA), eV:	-8.6(-2.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CNCC1=CC(=CN=C1)C2=CC\3=C(NN/C3=C\4/C=C5C(=N4)C=CC=C5C6=CC=NC=C6)N=C2

DOS

IR

Vibrations