octacesium [2-[3-[bis(oxidanidyl)methyl]pyridin-2-yl]pyridin-3-yl]methanediolate hexahydroxide

Systemtic Name: octacesium [2-[3-[bis(oxidanidyl)methyl]pyridin-2-yl]pyridin-3-yl]methanediolate hexahydroxide Openeye Name: octacesium [2-[3-(dioxidomethyl)-2-pyridyl]-3-pyridyl]methanediolate hexahydroxide CAS Name: octacesium [2-[3-(dioxidomethyl)-2-pyridinyl]-3-pyridinyl]methanediolate hexahydroxide IUPAC Name: octacesium [2-[3-(dioxidomethyl)pyridin-2-yl]pyridin-3-yl]methanediolate hexahydroxide Traditional Name: octacesium [2-[3-(dioxidomethyl)-2-pyridyl]-3-pyridyl]methanediolate hexahydroxide Formula: C12H14Cs8N2O10-2 MolecularWeight: 1409.49056

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)C2=C(C=CC=N2)C([O-])[O-])C([O-])[O-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[Cs+].[Cs+].[Cs+].[Cs+].[Cs+].[Cs+].[Cs+].[Cs+]

Isomeric SMILES

C1=CC(=C(N=C1)C2=C(C=CC=N2)C([O-])[O-])C([O-])[O-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[Cs+].[Cs+].[Cs+].[Cs+].[Cs+].[Cs+].[Cs+].[Cs+]

InChI

InChI=1S/C12H8N2O4.8Cs.6H2O/c15-11(16)7-3-1-5-13-9(7)10-8(12(17)18)4-2-6-14-10;;;;;;;;;;;;;;/h1-6,11-12H;;;;;;;;;6*1H2/q-4;8*+1;;;;;;/p-6