dinitrooxybismuthanyl nitrate; 1,4,5,6-tetrahydropyrimidin-3-ium-2-thiol

Systemtic Name: dinitrooxybismuthanyl nitrate; 1,4,5,6-tetrahydropyrimidin-3-ium-2-thiol Openeye Name: dinitrooxybismuthanyl nitrate; 1,4,5,6-tetrahydropyrimidin-3-ium-2-thiol CAS Name: nitric acid dinitrooxybismuthino ester; 1,4,5,6-tetrahydropyrimidin-3-ium-2-thiol IUPAC Name: dinitrooxybismuthanyl nitrate; 1,4,5,6-tetrahydropyrimidin-3-ium-2-thiol Traditional Name: nitric acid dinitrooxybismuthino ester; 1,4,5,6-tetrahydropyrimidin-3-ium-2-thiol Formula: C12H27BiN9O9S3+3 MolecularWeight: 746.57306

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(=[NH+]C1)S.C1CNC(=[NH+]C1)S.C1CNC(=[NH+]C1)S.[N+](=O)([O-])O[Bi](O[N+](=O)[O-])O[N+](=O)[O-]

Isomeric SMILES

C1CNC(=[NH+]C1)S.C1CNC(=[NH+]C1)S.C1CNC(=[NH+]C1)S.[N+](=O)([O-])O[Bi](O[N+](=O)[O-])O[N+](=O)[O-]

InChI

InChI=1S/3C4H8N2S.Bi.3NO3/c3*7-4-5-2-1-3-6-4;;3*2-1(3)4/h3*1-3H2,(H2,5,6,7);;;;/q;;;+3;3*-1/p+3