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Information card for entry 7133398
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Coordinates | 7133398.cif |
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Original paper (by DOI) | HTML |
Formula | C15 H16 N6 Ni O4 |
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Calculated formula | C15 H16 N6 Ni O4 |
Title of publication | Pressure-induced single-crystal-to-single-crystal nitrite ligand isomerisation accompanied by a piezochromic effect. |
Authors of publication | Potempa, Kinga; Paliwoda, Damian; Jarzembska, Katarzyna N.; Kamiński, Radosław; Krówczyński, Adam; Borowski, Patryk; Hanfland, Michael |
Journal of publication | Chemical communications (Cambridge, England) |
Year of publication | 2024 |
Journal volume | 60 |
Journal issue | 69 |
Pages of publication | 9194 - 9197 |
a | 12.836 ± 0.003 Å |
b | 9.391 ± 0.002 Å |
c | 12.908 ± 0.003 Å |
α | 90° |
β | 108.56 ± 0.03° |
γ | 90° |
Cell volume | 1475 ± 0.6 Å3 |
Cell temperature | 293 K |
Ambient diffraction temperature | 293 K |
Number of distinct elements | 5 |
Space group number | 9 |
Hermann-Mauguin space group symbol | C 1 c 1 |
Hall space group symbol | C -2yc |
Residual factor for all reflections | 0.104 |
Residual factor for significantly intense reflections | 0.0793 |
Weighted residual factors for significantly intense reflections | 0.2292 |
Weighted residual factors for all reflections included in the refinement | 0.2569 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.058 |
Diffraction radiation wavelength | 0.40965 Å |
Diffraction radiation type | synchrotron |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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The link is: https://www.crystallography.net/7133398.html
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