cobalt(2+); nickel(2+); titanium(2+); vanadium; pentaphosphate

Systemtic Name: cobalt(2+); nickel(2+); titanium(2+); vanadium; pentaphosphate Openeye Name: tricobaltous; trinickelous; titanium(2+); vanadium; pentaphosphate CAS Name: cobalt(2+); nickel(2+); titanium(2+); vanadium; pentaphosphate IUPAC Name: cobalt(2+); nickel(2+); titanium(2+); vanadium; pentaphosphate Traditional Name: tricobaltous; trinickelous; titanium(2+); vanadium; pentaphosphate Formula: Co3Ni3O20P5Ti3V3+3 MolecularWeight: 1124.162105

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Descriptors Computed from Structure

Canonical SMILES:

[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[Ti+2].[Ti+2].[Ti+2].[V].[V].[V].[Co+2].[Co+2].[Co+2].[Ni+2].[Ni+2].[Ni+2]

Isomeric SMILES

[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[Ti+2].[Ti+2].[Ti+2].[V].[V].[V].[Co+2].[Co+2].[Co+2].[Ni+2].[Ni+2].[Ni+2]

InChI

InChI=1S/3Co.3Ni.5H3O4P.3Ti.3V/c;;;;;;5*1-5(2,3)4;;;;;;/h;;;;;;5*(H3,1,2,3,4);;;;;;/q6*+2;;;;;;3*+2;;;/p-15