cadmium(2+); 1,10-phenanthroline; pyrimidine-2-thiolate

Systemtic Name: cadmium(2+); 1,10-phenanthroline; pyrimidine-2-thiolate Openeye Name: cadmium(2+); 1,10-phenanthroline; pyrimidine-2-thiolate CAS Name: cadmium(2+); 1,10-phenanthroline; 2-pyrimidinethiolate IUPAC Name: cadmium(2+); 1,10-phenanthroline; pyrimidine-2-thiolate Traditional Name: cadmium(2+); 1,10-phenanthroline; pyrimidine-2-thiolate Formula: C20H14CdN6S2 MolecularWeight: 514.90636

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1.C1=CN=C(N=C1)[S-].C1=CN=C(N=C1)[S-].[Cd+2]

Isomeric SMILES

C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1.C1=CN=C(N=C1)[S-].C1=CN=C(N=C1)[S-].[Cd+2]

InChI

InChI=1S/C12H8N2.2C4H4N2S.Cd/c1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1;2*7-4-5-2-1-3-6-4;/h1-8H;2*1-3H,(H,5,6,7);/q;;;+2/p-2