manganese(2+); 1,10-phenanthroline; disulfate

Systemtic Name: manganese(2+); 1,10-phenanthroline; disulfate Openeye Name: dimanganous 1,10-phenanthroline disulfate CAS Name: manganese(2+); 1,10-phenanthroline; disulfate IUPAC Name: manganese(2+); 1,10-phenanthroline; disulfate Traditional Name: dimanganous 1,10-phenanthroline disulfate Formula: C48H32Mn2N8O8S2 MolecularWeight: 1022.822578

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/4C12H8N2.2Mn.2H2O4S/c4*1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1;;;2*1-5(2,3)4/h4*1-8H;;;2*(H2,1,2,3,4)/q;;;;2*+2;;/p-4