chromium(6+); copper; 1,8-diaza-4,11-diazanidacyclotetradecane; dodecacyanide

Systemtic Name: chromium(6+); copper; 1,8-diaza-4,11-diazanidacyclotetradecane; dodecacyanide Openeye Name: dichromyl; copper; 1,8-diaza-4,11-diazanidacyclotetradecane; dodecacyanide CAS Name: chromium(6+); copper; 1,8-diaza-4,11-diazanidacyclotetradecane; dodecacyanide IUPAC Name: chromium(6+); copper; 1,8-diaza-4,11-diazanidacyclotetradecane; dodecacyanide Traditional Name: dichromyl; copper; 1,8-diaza-4,11-diazanidacyclotetradecane; dodecacyanide Formula: C42H66Cr2Cu3N24-6 MolecularWeight: 1201.76444

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.C1CNCC[N-]CCCNCC[N-]C1.C1CNCC[N-]CCCNCC[N-]C1.C1CNCC[N-]CCCNCC[N-]C1.[Cr+6].[Cr+6].[Cu].[Cu].[Cu]

Isomeric SMILES

[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.C1CNCC[N-]CCCNCC[N-]C1.C1CNCC[N-]CCCNCC[N-]C1.C1CNCC[N-]CCCNCC[N-]C1.[Cr+6].[Cr+6].[Cu].[Cu].[Cu]

InChI

InChI=1S/3C10H22N4.12CN.2Cr.3Cu/c3*1-3-11-7-9-13-5-2-6-14-10-8-12-4-1;12*1-2;;;;;/h3*11,14H,1-10H2;;;;;;;;;;;;;;;;;/q3*-2;12*-1;2*+6;;;