Geometry & MOs

Info

ID:	449307
PubChem CID:	135297526
Reduced:	N8H16C23 (1)
Stoich.:	A8B16C23 (1)
Weight, g/mol:	403.154544
ΔH_f, kcal/mol:	238.99
Dipole, Da:	4.98
IP(EA), eV:	-8.66(-2.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2Z)-7-(3-methylphenyl)-2-(5-pyridin-2-yl-1,2-dihydropyrazolo[4,3-b]pyridin-3-ylidene)imidazo[4,5-b]pyridine

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C2=CC=NC3=N/C(=C\4/C5=C(C=CC(=N5)C6=CN=CN=C6)NN4)/N=C23

DOS

IR

Vibrations