5-methyl-7-oxidanylidene-cyclohepta-1,3,5-trien-1-olate; thorium(4+)

Systemtic Name: 5-methyl-7-oxidanylidene-cyclohepta-1,3,5-trien-1-olate; thorium(4+) Openeye Name: 5-methyl-7-oxo-cyclohepta-1,3,5-trien-1-olate; thorium(4+) CAS Name: 5-methyl-7-oxo-1-cyclohepta-1,3,5-trienolate; thorium(4+) IUPAC Name: 5-methyl-7-oxocyclohepta-1,3,5-trien-1-olate; thorium(4+) Traditional Name: 7-keto-5-methyl-cyclohepta-1,3,5-trien-1-olate; thorium(4+) Formula: C32H28O8Th MolecularWeight: 772.59802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=CC=C1)[O-].CC1=CC(=O)C(=CC=C1)[O-].CC1=CC(=O)C(=CC=C1)[O-].CC1=CC(=O)C(=CC=C1)[O-].[Th+4]

Isomeric SMILES

CC1=CC(=O)C(=CC=C1)[O-].CC1=CC(=O)C(=CC=C1)[O-].CC1=CC(=O)C(=CC=C1)[O-].CC1=CC(=O)C(=CC=C1)[O-].[Th+4]

InChI

InChI=1S/4C8H8O2.Th/c4*1-6-3-2-4-7(9)8(10)5-6;/h4*2-5H,1H3,(H,9,10);/q;;;;+4/p-4