cobalt(3+); 1-methyl-8-nitro-3,6,10,13,16,19-hexazabicyclo[6.6.6]icosane; trichloride

Systemtic Name: cobalt(3+); 1-methyl-8-nitro-3,6,10,13,16,19-hexazabicyclo[6.6.6]icosane; trichloride Openeye Name: cobaltic 1-methyl-8-nitro-3,6,10,13,16,19-hexazabicyclo[6.6.6]icosane trichloride CAS Name: cobalt(3+); 1-methyl-8-nitro-3,6,10,13,16,19-hexazabicyclo[6.6.6]eicosane; trichloride IUPAC Name: cobalt(3+); 1-methyl-8-nitro-3,6,10,13,16,19-hexazabicyclo[6.6.6]icosane; trichloride Traditional Name: cobaltic 1-methyl-8-nitro-3,6,10,13,16,19-hexazabicyclo[6.6.6]eicosane trichloride Formula: C15H33Cl3CoN7O2 MolecularWeight: 508.76042

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Descriptors Computed from Structure

Canonical SMILES:

CC12CNCCNCC(CNCCNC1)(CNCCNC2)[N+](=O)[O-].[Cl-].[Cl-].[Cl-].[Co+3]

Isomeric SMILES

CC12CNCCNCC(CNCCNC1)(CNCCNC2)[N+](=O)[O-].[Cl-].[Cl-].[Cl-].[Co+3]

InChI

InChI=1S/C15H33N7O2.3ClH.Co/c1-14-8-16-2-5-19-11-15(22(23)24,12-20-6-3-17-9-14)13-21-7-4-18-10-14;;;;/h16-21H,2-13H2,1H3;3*1H;/q;;;;+3/p-3