4-bromanylbenzenethiolate; 2,6-dipyridin-2-ylpyridine; platinum(2+); chloride

Systemtic Name: 4-bromanylbenzenethiolate; 2,6-dipyridin-2-ylpyridine; platinum(2+); chloride Openeye Name: 2,6-bis(2-pyridyl)pyridine; 4-bromobenzenethiolate; platinum(2+); chloride CAS Name: 2,6-bis(2-pyridinyl)pyridine; 4-bromobenzenethiolate; platinum(2+); chloride IUPAC Name: 4-bromobenzenethiolate; 2,6-dipyridin-2-ylpyridine; platinum(2+); chloride Traditional Name: 2,6-bis(2-pyridyl)pyridine; 4-bromobenzenethiolate; platinum(2+); chloride Formula: C21H15BrClN3PtS MolecularWeight: 651.8639

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C2=NC(=CC=C2)C3=CC=CC=N3.C1=CC(=CC=C1[S-])Br.[Cl-].[Pt+2]

Isomeric SMILES

C1=CC=NC(=C1)C2=NC(=CC=C2)C3=CC=CC=N3.C1=CC(=CC=C1[S-])Br.[Cl-].[Pt+2]

InChI

InChI=1S/C15H11N3.C6H5BrS.ClH.Pt/c1-3-10-16-12(6-1)14-8-5-9-15(18-14)13-7-2-4-11-17-13;7-5-1-3-6(8)4-2-5;;/h1-11H;1-4,8H;1H;/q;;;+2/p-2