dicopper dioxidanium 7H-purin-6-amine

Systemtic Name: dicopper dioxidanium 7H-purin-6-amine Openeye Name: dicopper dioxonium 7H-purin-6-amine CAS Name: dicopper dioxonium 7H-purin-6-amine IUPAC Name: dicopper dioxidanium 7H-purin-6-amine Traditional Name: dicupric dioxonium 7H-adenine Formula: C20H26Cu2N20O2+6 MolecularWeight: 705.64524

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1)C(=NC=N2)N.C1=NC2=C(N1)C(=NC=N2)N.C1=NC2=C(N1)C(=NC=N2)N.C1=NC2=C(N1)C(=NC=N2)N.[OH3+].[OH3+].[Cu+2].[Cu+2]

Isomeric SMILES

C1=NC2=C(N1)C(=NC=N2)N.C1=NC2=C(N1)C(=NC=N2)N.C1=NC2=C(N1)C(=NC=N2)N.C1=NC2=C(N1)C(=NC=N2)N.[OH3+].[OH3+].[Cu+2].[Cu+2]

InChI

InChI=1S/4C5H5N5.2Cu.2H2O/c4*6-4-3-5(9-1-7-3)10-2-8-4;;;;/h4*1-2H,(H3,6,7,8,9,10);;;2*1H2/q;;;;2*+2;;/p+2