Geometry & MOs

Info

ID:	308894
PubChem CID:	126531801
Reduced:	OSN8H22C26 (1)
Stoich.:	ABC8D22E26 (1)
Weight, g/mol:	410.09498
ΔH_f, kcal/mol:	184.94
Dipole, Da:	5.07
IP(EA), eV:	-8.62(-2.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN(C)CC(=O)NC1=CN=CC(=C1)C2=NC\3=C(C=C2)NN/C3=C/4\C=C5C(=N4)C=CN=C5C6=CSC=C6

DOS

IR

Vibrations