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Information card for entry 7706928
Preview
Coordinates | 7706928.cif |
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Original paper (by DOI) | HTML |
Formula | C6 H10 N6 O9 Zn |
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Calculated formula | C6 H10 N6 O9 Zn |
Title of publication | Zn(H<sub>2</sub>C<sub>3</sub>N<sub>3</sub>O<sub>3</sub>)<sub>2</sub>·3H<sub>2</sub>O: the first single-<i>d</i><sup>10</sup> transition metal based ultraviolet hydroisocyanurate crystal with large birefringence. |
Authors of publication | Wang, Dandan; Zhang, Xinyuan; Liang, Fei; Hu, Zhanggui; Wu, Yicheng |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2021 |
Journal volume | 50 |
Journal issue | 16 |
Pages of publication | 5617 - 5623 |
a | 6.7905 ± 0.0012 Å |
b | 9.2047 ± 0.0016 Å |
c | 11.672 ± 0.002 Å |
α | 103.573 ± 0.005° |
β | 106.316 ± 0.006° |
γ | 105.106 ± 0.005° |
Cell volume | 637.6 ± 0.2 Å3 |
Cell temperature | 298 ± 2 K |
Ambient diffraction temperature | 298 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.052 |
Residual factor for significantly intense reflections | 0.0392 |
Weighted residual factors for significantly intense reflections | 0.0859 |
Weighted residual factors for all reflections included in the refinement | 0.0936 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.059 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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