Geometry & MOs

Info

ID:	449308
PubChem CID:	135297528
Reduced:	N7H17C24 (1)
Stoich.:	A7B17C24 (1)
Weight, g/mol:	407.185844
ΔH_f, kcal/mol:	226.45
Dipole, Da:	5.23
IP(EA), eV:	-8.52(-2.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2Z)-7-(3-methylphenyl)-2-[5-(1,2,3,6-tetrahydropyridin-4-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=CC=CC=N6)NN4)/N=C23

DOS

IR

Vibrations