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Crystal structure of 2,3,5,6-tetrakis(pyridin-2-yl)pyrazine hydrogen peroxide 4.75-solvate
The structure of the title co-crystal, C(24)H(16)N(6)·4.75H(2)O(2), consists of a 2,3,5,6-tetrakis(pyridin-2-yl)pyrazine coformer and hydrogen peroxide solvent molecules in an overall ratio of 1:4.75. Three of the six H(2)O(2) molecules modelled in the structure were found to be cross-orientatio...
Autores principales: | , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2017
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5683516/ https://www.ncbi.nlm.nih.gov/pubmed/29152376 http://dx.doi.org/10.1107/S2056989017015328 |
Sumario: | The structure of the title co-crystal, C(24)H(16)N(6)·4.75H(2)O(2), consists of a 2,3,5,6-tetrakis(pyridin-2-yl)pyrazine coformer and hydrogen peroxide solvent molecules in an overall ratio of 1:4.75. Three of the six H(2)O(2) molecules modelled in the structure were found to be cross-orientationally disordered over two positions with occupancy ratios 0.846 (9):0.154 (9), 0.75 (2):0.25 (2), and 0.891 (9):0.109 (9). In the crystal, all of the peroxide molecules are linked into hydrogen-bonded chains that propagate parallel to the a axis. These chains are further linked by O—H⋯N hydrogen bonds to the pyridine groups of the main molecule. |
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