tricalcium oxidanidyl(oxidanylidene)alumane carbonate hydrate

Systemtic Name: tricalcium oxidanidyl(oxidanylidene)alumane carbonate hydrate Openeye Name: tricalcium oxido(oxo)alumane carbonate hydrate CAS Name: tricalcium oxido(oxo)alumane carbonate hydrate IUPAC Name: tricalcium oxido(oxo)alumane carbonate hydrate Traditional Name: tricalcium keto(oxido)alumane carbonate hydrate Formula: CH2AlCa3O6+3 MolecularWeight: 257.238518

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Descriptors Computed from Structure

Canonical SMILES:

C(=O)([O-])[O-].O.[O-][Al]=O.[Ca+2].[Ca+2].[Ca+2]

Isomeric SMILES

C(=O)([O-])[O-].O.[O-][Al]=O.[Ca+2].[Ca+2].[Ca+2]

InChI

InChI=1S/CH2O3.Al.3Ca.H2O.2O/c2-1(3)4;;;;;;;/h(H2,2,3,4);;;;;1H2;;/q;;3*+2;;;-1/p-2