carbon monoxide; cobalt; (3Z,7R,8R)-7,8-diphenylcyclooct-3-en-1,5-diyne

Systemtic Name: carbon monoxide; cobalt; (3Z,7R,8R)-7,8-diphenylcyclooct-3-en-1,5-diyne Openeye Name: carbon monoxide; cobalt; (3Z,7R,8R)-7,8-diphenylcyclooct-3-en-1,5-diyne CAS Name: carbon monoxide; cobalt; (3Z,7R,8R)-7,8-diphenylcyclooct-3-en-1,5-diyne IUPAC Name: carbon monoxide; cobalt; (3Z,7R,8R)-7,8-diphenylcyclooct-3-en-1,5-diyne Traditional Name: carbon monoxide; cobalt; (3Z,7R,8R)-7,8-diphenylcyclooct-3-en-1,5-diyne Formula: C32H14Co4O12 MolecularWeight: 826.17916

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].C1=CC=C(C=C1)C2C#CC=CC#CC2C3=CC=CC=C3.[Co].[Co].[Co].[Co]

Isomeric SMILES

[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].C1=CC=C(C=C1)[C@@H]2C#C/C=C\C#C[C@H]2C3=CC=CC=C3.[Co].[Co].[Co].[Co]

InChI

InChI=1S/C20H14.12CO.4Co/c1-2-10-16-20(18-13-7-4-8-14-18)19(15-9-1)17-11-5-3-6-12-17;12*1-2;;;;/h1-8,11-14,19-20H;;;;;;;;;;;;;;;;/b2-1-;;;;;;;;;;;;;;;;/t19-,20-;;;;;;;;;;;;;;;;/m0................/s1