1,2-bis(2-phenylethynyl)benzene; carbon monoxide; chromium

Systemtic Name: 1,2-bis(2-phenylethynyl)benzene; carbon monoxide; chromium Openeye Name: 1,2-bis(2-phenylethynyl)benzene; carbon monoxide; chromium CAS Name: 1,2-bis(2-phenylethynyl)benzene; carbon monoxide; chromium IUPAC Name: 1,2-bis(2-phenylethynyl)benzene; carbon monoxide; chromium Traditional Name: 1,2-bis(2-phenylethynyl)benzene; carbon monoxide; chromium Formula: C28H14Cr2O6 MolecularWeight: 550.39936

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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)C#CC2=CC=CC=C2C#CC3=CC=CC=C3.[Cr].[Cr]

Isomeric SMILES

[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].C1=CC=C(C=C1)C#CC2=CC=CC=C2C#CC3=CC=CC=C3.[Cr].[Cr]

InChI

InChI=1S/C22H14.6CO.2Cr/c1-3-9-19(10-4-1)15-17-21-13-7-8-14-22(21)18-16-20-11-5-2-6-12-20;6*1-2;;/h1-14H;;;;;;;;