Geometry & MOs

Info

ID:	79854
PubChem CID:	49830858
Reduced:	ON4H14C18 (1)
Stoich.:	AB4C14D18 (1)
Weight, g/mol:	234.090546
ΔH_f, kcal/mol:	46.49
Dipole, Da:	1.49
IP(EA), eV:	-9.09(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(1H-indazol-6-yl)-1H-pyrrolo[2,3-b]pyridine

Drug info:

PubChemData

Smile

CC(=O)NC1=NC(=C(C(=C1)N)C#N)C2=CC3=CC=CC=C3C=C2

DOS

IR

Vibrations