carbon monoxide; ruthenium; 1,5,9-trimethyl-5,9-diaza-1-azoniacyclododecane

Systemtic Name: carbon monoxide; ruthenium; 1,5,9-trimethyl-5,9-diaza-1-azoniacyclododecane Openeye Name: carbon monoxide; ruthenium; 1,5,9-trimethyl-5,9-diaza-1-azoniacyclododecane CAS Name: carbon monoxide; ruthenium; 1,5,9-trimethyl-5,9-diaza-1-azoniacyclododecane IUPAC Name: carbon monoxide; ruthenium; 1,5,9-trimethyl-5,9-diaza-1-azoniacyclododecane Traditional Name: carbon monoxide; ruthenium; 1,5,9-trimethyl-5,9-diaza-1-azoniacyclododecane Formula: C24H28N3O12Ru4+ MolecularWeight: 954.77202

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCN(CCCN(CCC1)C)C.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Ru].[Ru].[Ru].[Ru]

Isomeric SMILES

C[NH+]1CCCN(CCCN(CCC1)C)C.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Ru].[Ru].[Ru].[Ru]

InChI

InChI=1S/C12H27N3.12CO.4Ru/c1-13-7-4-9-14(2)11-6-12-15(3)10-5-8-13;12*1-2;;;;/h4-12H2,1-3H3;;;;;;;;;;;;;;;;/p+1