Geometry & MOs

Info

ID:	308742
PubChem CID:	126522438
Reduced:	N4C11H11 (2)
Stoich.:	A4B11C11 (2)
Weight, g/mol:	405.133808
ΔH_f, kcal/mol:	182.26
Dipole, Da:	4.1
IP(EA), eV:	-8.78(-2.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(3E)-3-(4-pyridin-4-ylpyrrolo[2,3-b]pyridin-2-ylidene)-1,2-dihydropyrazolo[3,4-c]pyridin-5-yl]pyridin-3-ol

Drug info:

PubChemData

Smile

CC1=CN(C=N1)C2=CC=NC3=N/C(=C/4\C5=CC(=NC=C5NN4)C6CCNCC6)/C=C23

DOS

IR

Vibrations