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Information card for entry 4124904
Preview
Coordinates | 4124904.cif |
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Original paper (by DOI) | HTML |
Formula | C24 H26 B2 Fe N8 O8 |
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Calculated formula | C24 H26 B2 Fe N8 O8 |
Title of publication | Ligand Aspect Ratio as a Decisive Factor for the Self-Assembly of Coordination Cages. |
Authors of publication | Jansze, Suzanne M.; Cecot, Giacomo; Wise, Matthew D.; Zhurov, Konstantin O.; Ronson, Tanya K.; Castilla, Ana M.; Finelli, Alba; Pattison, Philip; Solari, Euro; Scopelliti, Rosario; Zelinskii, Genrikh E.; Vologzhanina, Anna V.; Voloshin, Yan Z.; Nitschke, Jonathan R.; Severin, Kay |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2016 |
Journal volume | 138 |
Journal issue | 6 |
Pages of publication | 2046 - 2054 |
a | 23.908 ± 0.005 Å |
b | 8.0758 ± 0.0016 Å |
c | 16.326 ± 0.003 Å |
α | 90° |
β | 122.21 ± 0.03° |
γ | 90° |
Cell volume | 2667 ± 1.3 Å3 |
Cell temperature | 120 ± 2 K |
Ambient diffraction temperature | 120.15 K |
Number of distinct elements | 6 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.0818 |
Residual factor for significantly intense reflections | 0.0523 |
Weighted residual factors for significantly intense reflections | 0.1037 |
Weighted residual factors for all reflections included in the refinement | 0.1177 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.163 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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