copper; 5,5,7,12,12,14-hexamethyl-1,4,8,11-tetrazacyclotetradecane; diisothiocyanate

Systemtic Name: copper; 5,5,7,12,12,14-hexamethyl-1,4,8,11-tetrazacyclotetradecane; diisothiocyanate Openeye Name: copper; 5,5,7,12,12,14-hexamethyl-1,4,8,11-tetrazacyclotetradecane; diisothiocyanate CAS Name: copper; 5,5,7,12,12,14-hexamethyl-1,4,8,11-tetrazacyclotetradecane; diisothiocyanate IUPAC Name: copper; 5,5,7,12,12,14-hexamethyl-1,4,8,11-tetrazacyclotetradecane; diisothiocyanate Traditional Name: copper; 5,5,7,12,12,14-hexamethyl-1,4,8,11-tetrazacyclotetradecane; diisothiocyanate Formula: C18H36CuN6S2-2 MolecularWeight: 464.19464

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(NCCNC(CC(NCCN1)(C)C)C)(C)C.C(=[N-])=S.C(=[N-])=S.[Cu]

Isomeric SMILES

CC1CC(NCCNC(CC(NCCN1)(C)C)C)(C)C.C(=[N-])=S.C(=[N-])=S.[Cu]

InChI

InChI=1S/C16H36N4.2CNS.Cu/c1-13-11-15(3,4)19-10-8-18-14(2)12-16(5,6)20-9-7-17-13;2*2-1-3;/h13-14,17-20H,7-12H2,1-6H3;;;/q;2*-1;