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Information card for entry 7133922
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Coordinates | 7133922.cif |
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Original paper (by DOI) | HTML |
Common name | Ru(BPPy)(CO)(MeCN) |
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Chemical name | acetonitrilecarbonyl{5,10,15,20-tetrakis(4-(7-tert-butyl)-pyrene-2-yl)phenyl)porphyrinato}ruthenium(II) |
Formula | C136 H108 Cl3 N9 O Ru |
Calculated formula | C136 H108 Cl3 N9 O Ru |
Title of publication | Development of a Ru-porphyrin-based supramolecular framework catalyst for styrene epoxidation. |
Authors of publication | Yoneda, Akira; Watanabe, Taito; Kosugi, Kento; Takahara, Teppei; Kusaka, Shinpei; Matsuda, Ryotaro; Saga, Yutaka; Kambe, Tetsuya; Kondo, Mio; Masaoka, Shigeyuki |
Journal of publication | Chemical communications (Cambridge, England) |
Year of publication | 2024 |
Journal volume | 60 |
Journal issue | 94 |
Pages of publication | 13939 - 13942 |
a | 15.3821 ± 0.0002 Å |
b | 16.7184 ± 0.0004 Å |
c | 23.3719 ± 0.0003 Å |
α | 102.612 ± 0.002° |
β | 104.135 ± 0.001° |
γ | 93.651 ± 0.001° |
Cell volume | 5644.16 ± 0.18 Å3 |
Cell temperature | 123 ± 0.1 K |
Ambient diffraction temperature | 123.15 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1148 |
Residual factor for significantly intense reflections | 0.082 |
Weighted residual factors for significantly intense reflections | 0.2286 |
Weighted residual factors for all reflections included in the refinement | 0.2499 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.054 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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The link is: https://www.crystallography.net/7133922.html
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