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Information card for entry 7704478
Preview
Coordinates | 7704478.cif |
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Original paper (by DOI) | HTML |
Formula | C108 H126 N20 O42 Zn5 |
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Calculated formula | C108 H126 N20 O42 Zn5 |
Title of publication | Synthesis and catalytic activities of a Zn(ii) based metallomacrocycle and a metal-organic framework towards one-pot deacetalization-Knoevenagel tandem reactions under different strategies: a comparative study. |
Authors of publication | Karmakar, Anirban; Soliman, Mohamed M. A.; Rúbio, Guilherme M D M; Guedes da Silva, M Fátima C; Pombeiro, Armando J. L. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2020 |
Journal volume | 49 |
Journal issue | 24 |
Pages of publication | 8075 - 8085 |
a | 15.6267 ± 0.0016 Å |
b | 15.6542 ± 0.0015 Å |
c | 19.192 ± 0.0017 Å |
α | 111.05 ± 0.003° |
β | 99.873 ± 0.003° |
γ | 106.17 ± 0.004° |
Cell volume | 4010.5 ± 0.7 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 ± 2 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 | 0.1024 |
Residual factor for significantly intense reflections | 0.0888 |
Weighted residual factors for significantly intense reflections | 0.2612 |
Weighted residual factors for all reflections included in the refinement | 0.2751 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.124 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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