N'-(2-azanylethyl)ethane-1,2-diamine; ruthenium(4+); icosaethanoate

Systemtic Name: N'-(2-azanylethyl)ethane-1,2-diamine; ruthenium(4+); icosaethanoate Openeye Name: N'-(2-aminoethyl)ethane-1,2-diamine; ruthenium(4+); icosaacetate CAS Name: N'-(2-aminoethyl)ethane-1,2-diamine; ruthenium(4+); eicosaacetate IUPAC Name: N'-(2-aminoethyl)ethane-1,2-diamine; ruthenium(4+); icosaacetate Traditional Name: bis(2-aminoethyl)amine; ruthenium(4+); eicosaacetate Formula: C56H112N12O40Ru5 MolecularWeight: 2098.89488

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].C(CNCCN)N.C(CNCCN)N.C(CNCCN)N.C(CNCCN)N.[Ru+4].[Ru+4].[Ru+4].[Ru+4].[Ru+4]

Isomeric SMILES

CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].C(CNCCN)N.C(CNCCN)N.C(CNCCN)N.C(CNCCN)N.[Ru+4].[Ru+4].[Ru+4].[Ru+4].[Ru+4]

InChI

InChI=1S/4C4H13N3.20C2H4O2.5Ru/c4*5-1-3-7-4-2-6;20*1-2(3)4;;;;;/h4*7H,1-6H2;20*1H3,(H,3,4);;;;;/q;;;;;;;;;;;;;;;;;;;;;;;;5*+4/p-20