carbon monoxide; cobalt; 3-diphenylphosphanylbenzenesulfonic acid

Systemtic Name: carbon monoxide; cobalt; 3-diphenylphosphanylbenzenesulfonic acid Openeye Name: carbon monoxide; cobalt; 3-diphenylphosphanylbenzenesulfonic acid CAS Name: carbon monoxide; cobalt; 3-diphenylphosphinobenzenesulfonic acid IUPAC Name: carbon monoxide; cobalt; 3-diphenylphosphanylbenzenesulfonic acid Traditional Name: carbon monoxide; cobalt; 3-diphenylphosphinobesylic acid Formula: C42H30Co2O12P2S2 MolecularWeight: 970.624322

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC(=CC=C3)S(=O)(=O)O.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC(=CC=C3)S(=O)(=O)O.[Co].[Co]

Isomeric SMILES

[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC(=CC=C3)S(=O)(=O)O.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC(=CC=C3)S(=O)(=O)O.[Co].[Co]

InChI

InChI=1S/2C18H15O3PS.6CO.2Co/c2*19-23(20,21)18-13-7-12-17(14-18)22(15-8-3-1-4-9-15)16-10-5-2-6-11-16;6*1-2;;/h2*1-14H,(H,19,20,21);;;;;;;;