Geometry & MOs

Info

ID:	443899
PubChem CID:	135260324
Reduced:	N8H20C21 (1)
Stoich.:	A8B20C21 (1)
Weight, g/mol:	326.127994
ΔH_f, kcal/mol:	192.94
Dipole, Da:	7.39
IP(EA), eV:	-8.15(-1.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3E)-5-(4-methylpyridin-3-yl)-3-pyrrolo[3,2-c]pyridin-2-ylidene-1,2-dihydropyrazolo[4,3-b]pyridine

Drug info:

PubChemData

Smile

C1CCN(CC1)C2=NC=CC3=N/C(=C/4\C5=C(C=CC(=N5)C6=CNN=C6)NN4)/C=C32

DOS

IR

Vibrations