cyano(phenyl)azanide; manganese; methanol; 1,10-phenanthroline-1,10-diide

Systemtic Name: cyano(phenyl)azanide; manganese; methanol; 1,10-phenanthroline-1,10-diide Openeye Name: cyano(phenyl)azanide; manganese; methanol; 1,10-phenanthroline-1,10-diide CAS Name: cyano(phenyl)azanide; manganese; methanol; 1,10-phenanthroline-1,10-diide IUPAC Name: cyano(phenyl)azanide; manganese; methanol; 1,10-phenanthroline-1,10-diide Traditional Name: cyano(phenyl)azanide; manganese; methanol; 1,10-phenanthroline-1,10-diide Formula: C54H44Mn2N12O2-8 MolecularWeight: 1002.882458

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Descriptors Computed from Structure

Canonical SMILES:

CO.CO.C1=CC=C(C=C1)[N-]C#N.C1=CC=C(C=C1)[N-]C#N.C1=CC=C(C=C1)[N-]C#N.C1=CC=C(C=C1)[N-]C#N.C1=C[N-]C2=C3C(=CC=C[N-]3)C=CC2=C1.C1=C[N-]C2=C3C(=CC=C[N-]3)C=CC2=C1.[Mn].[Mn]

Isomeric SMILES

CO.CO.C1=CC=C(C=C1)[N-]C#N.C1=CC=C(C=C1)[N-]C#N.C1=CC=C(C=C1)[N-]C#N.C1=CC=C(C=C1)[N-]C#N.C1=C[N-]C2=C3C(=CC=C[N-]3)C=CC2=C1.C1=C[N-]C2=C3C(=CC=C[N-]3)C=CC2=C1.[Mn].[Mn]

InChI

InChI=1S/2C12H8N2.4C7H5N2.2CH4O.2Mn/c2*1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1;4*8-6-9-7-4-2-1-3-5-7;2*1-2;;/h2*1-8H;4*1-5H;2*2H,1H3;;/q2*-2;4*-1;;;;