2,9-dimethyl-1,10-phenanthroline-1,10-diide; 4-nitrobenzenethiolate; zinc

Systemtic Name: 2,9-dimethyl-1,10-phenanthroline-1,10-diide; 4-nitrobenzenethiolate; zinc Openeye Name: 2,9-dimethyl-1,10-phenanthroline-1,10-diide; 4-nitrobenzenethiolate; zinc CAS Name: 2,9-dimethyl-1,10-phenanthroline-1,10-diide; 4-nitrobenzenethiolate; zinc IUPAC Name: 2,9-dimethyl-1,10-phenanthroline-1,10-diide; 4-nitrobenzenethiolate; zinc Traditional Name: 2,9-dimethyl-1,10-phenanthroline-1,10-diide; 4-nitrobenzenethiolate; zinc Formula: C26H20N4O4S2Zn-4 MolecularWeight: 582.0004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C2C=CC3=CC=C([N-]C3=C2[N-]1)C.C1=CC(=CC=C1[N+](=O)[O-])[S-].C1=CC(=CC=C1[N+](=O)[O-])[S-].[Zn]

Isomeric SMILES

CC1=CC=C2C=CC3=CC=C([N-]C3=C2[N-]1)C.C1=CC(=CC=C1[N+](=O)[O-])[S-].C1=CC(=CC=C1[N+](=O)[O-])[S-].[Zn]

InChI

InChI=1S/C14H12N2.2C6H5NO2S.Zn/c1-9-3-5-11-7-8-12-6-4-10(2)16-14(12)13(11)15-9;2*8-7(9)5-1-3-6(10)4-2-5;/h3-8H,1-2H3;2*1-4,10H;/q-2;;;/p-2