Geometry & MOs

Info

ID:	432821
PubChem CID:	135172958
Reduced:	O3N4H28C31 (1)
Stoich.:	A3B4C28D31 (1)
Weight, g/mol:	492.218621
ΔH_f, kcal/mol:	3.0
Dipole, Da:	3.69
IP(EA), eV:	-8.38(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(3Z)-3-[7-(3-fluorophenyl)imidazo[4,5-c]pyridin-2-ylidene]-1,2-dihydropyrazolo[3,4-c]pyridin-5-yl]-N-pentylpyridin-3-amine

Drug info:

PubChemData

Smile

C1CN(CCC1C(=O)CC2C3=CC=CC=C3C4=CN=CN24)C(=O)COC5=CC6=C(C=C5)NC7=CC=CC=C76

DOS

IR

Vibrations