bismuth; 4-methyl-3-oxidanylidene-pent-4-en-2-olate; titanium(4+)

Systemtic Name: bismuth; 4-methyl-3-oxidanylidene-pent-4-en-2-olate; titanium(4+) Openeye Name: bismuth; 4-methyl-3-oxo-pent-4-en-2-olate; titanium(4+) CAS Name: bismuth; 4-methyl-3-oxo-4-penten-2-olate; titanium(4+) IUPAC Name: bismuth; 4-methyl-3-oxopent-4-en-2-olate; titanium(4+) Traditional Name: bismuth; 3-keto-4-methyl-pent-4-en-2-olate; titanium(4+) Formula: C42H63BiO14Ti MolecularWeight: 1048.7886

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C(=C)C)[O-].CC(C(=O)C(=C)C)[O-].CC(C(=O)C(=C)C)[O-].CC(C(=O)C(=C)C)[O-].CC(C(=O)C(=C)C)[O-].CC(C(=O)C(=C)C)[O-].CC(C(=O)C(=C)C)[O-].[Ti+4].[Bi+3]

Isomeric SMILES

CC(C(=O)C(=C)C)[O-].CC(C(=O)C(=C)C)[O-].CC(C(=O)C(=C)C)[O-].CC(C(=O)C(=C)C)[O-].CC(C(=O)C(=C)C)[O-].CC(C(=O)C(=C)C)[O-].CC(C(=O)C(=C)C)[O-].[Ti+4].[Bi+3]

InChI

InChI=1S/7C6H9O2.Bi.Ti/c7*1-4(2)6(8)5(3)7;;/h7*5H,1H2,2-3H3;;/q7*-1;+3;+4