carbon monoxide; 2-phenylethynylbenzene; (2,3,4-triphenylcyclobuta-1,3-dien-1-yl)benzene; tungsten

Systemtic Name: carbon monoxide; 2-phenylethynylbenzene; (2,3,4-triphenylcyclobuta-1,3-dien-1-yl)benzene; tungsten Openeye Name: carbon monoxide; 2-phenylethynylbenzene; (2,3,4-triphenylcyclobuta-1,3-dien-1-yl)benzene; tungsten CAS Name: carbon monoxide; 2-phenylethynylbenzene; (2,3,4-triphenyl-1-cyclobuta-1,3-dienyl)benzene; tungsten IUPAC Name: carbon monoxide; 2-phenylethynylbenzene; (2,3,4-triphenylcyclobuta-1,3-dien-1-yl)benzene; tungsten Traditional Name: carbon monoxide; 2-phenylethynylbenzene; (2,3,4-triphenylcyclobuta-1,3-dien-1-yl)benzene; tungsten Formula: C57H40OW MolecularWeight: 924.7669

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#[O+].C1=CC=C(C=C1)C#CC2=CC=CC=C2.C1=CC=C(C=C1)C#CC2=CC=CC=C2.C1=CC=C(C=C1)C2=C(C(=C2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5.[W]

Isomeric SMILES

[C-]#[O+].C1=CC=C(C=C1)C#CC2=CC=CC=C2.C1=CC=C(C=C1)C#CC2=CC=CC=C2.C1=CC=C(C=C1)C2=C(C(=C2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5.[W]

InChI

InChI=1S/C28H20.2C14H10.CO.W/c1-5-13-21(14-6-1)25-26(22-15-7-2-8-16-22)28(24-19-11-4-12-20-24)27(25)23-17-9-3-10-18-23;2*1-3-7-13(8-4-1)11-12-14-9-5-2-6-10-14;1-2;/h1-20H;2*1-10H;;