2-azanyl-3,7-dihydropurin-6-one; carbon monoxide; ruthenium(2+); dichloride

Systemtic Name: 2-azanyl-3,7-dihydropurin-6-one; carbon monoxide; ruthenium(2+); dichloride Openeye Name: 2-amino-3,7-dihydropurin-6-one; carbon monoxide; ruthenium(2+); dichloride CAS Name: 2-amino-3,7-dihydropurin-6-one; carbon monoxide; ruthenium(2+); dichloride IUPAC Name: 2-amino-3,7-dihydropurin-6-one; carbon monoxide; ruthenium(2+); dichloride Traditional Name: 2-amino-3,7-dihydropurin-6-one; carbon monoxide; ruthenium(2+); dichloride Formula: C13H10Cl2N10O5Ru MolecularWeight: 558.2585

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#[O+].[C-]#[O+].[C-]#[O+].C1=NC2=C(N1)C(=O)N=C(N2)N.C1=NC2=C(N1)C(=O)N=C(N2)N.[Cl-].[Cl-].[Ru+2]

Isomeric SMILES

[C-]#[O+].[C-]#[O+].[C-]#[O+].C1=NC2=C(N1)C(=O)N=C(N2)N.C1=NC2=C(N1)C(=O)N=C(N2)N.[Cl-].[Cl-].[Ru+2]

InChI

InChI=1S/2C5H5N5O.3CO.2ClH.Ru/c2*6-5-9-3-2(4(11)10-5)7-1-8-3;3*1-2;;;/h2*1H,(H4,6,7,8,9,10,11);;;;2*1H;/q;;;;;;;+2/p-2