1,4-bis(2-phenylethynyl)benzene; carbon monoxide; chromium

Systemtic Name: 1,4-bis(2-phenylethynyl)benzene; carbon monoxide; chromium Openeye Name: 1,4-bis(2-phenylethynyl)benzene; carbon monoxide; chromium CAS Name: 1,4-bis(2-phenylethynyl)benzene; carbon monoxide; chromium IUPAC Name: 1,4-bis(2-phenylethynyl)benzene; carbon monoxide; chromium Traditional Name: 1,4-bis(2-phenylethynyl)benzene; carbon monoxide; chromium Formula: C25H14CrO3 MolecularWeight: 414.37296

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#[O+].[C-]#[O+].[C-]#[O+].C1=CC=C(C=C1)C#CC2=CC=C(C=C2)C#CC3=CC=CC=C3.[Cr]

Isomeric SMILES

[C-]#[O+].[C-]#[O+].[C-]#[O+].C1=CC=C(C=C1)C#CC2=CC=C(C=C2)C#CC3=CC=CC=C3.[Cr]

InChI

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