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Information card for entry 1550433
Preview
Coordinates | 1550433.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | [PdCl(PNP-C2-Me)](PF6) |
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Formula | C35 H30 Cl3 F6 N O4.4 P3 Pd |
Calculated formula | C35 H30 Cl3 F6 N O4.4 P3 Pd |
Title of publication | Performance of enhanced DuBois type water reduction catalysts (WRC) in artificial photosynthesis - effects of various proton relays during catalysis. |
Authors of publication | Viertl, Wolfgang; Pann, Johann; Pehn, Richard; Roithmeyer, Helena; Bendig, Marvin; Rodríguez-Villalón, Alba; Bereiter, Raphael; Heiderscheid, Max; Müller, Thomas; Zhao, Xia; Hofer, Thomas S.; Thompson, Mark E.; Shi, Shuyang; Brueggeller, Peter |
Journal of publication | Faraday discussions |
Year of publication | 2019 |
Journal volume | 215 |
Journal issue | 0 |
Pages of publication | 141 - 161 |
a | 12.3522 ± 0.0003 Å |
b | 26.1118 ± 0.0006 Å |
c | 13.6448 ± 0.0003 Å |
α | 90° |
β | 113.138 ± 0.001° |
γ | 90° |
Cell volume | 4046.96 ± 0.16 Å3 |
Cell temperature | 193 ± 2 K |
Ambient diffraction temperature | 193 ± 2 K |
Number of distinct elements | 8 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.0424 |
Residual factor for significantly intense reflections | 0.0387 |
Weighted residual factors for significantly intense reflections | 0.1017 |
Weighted residual factors for all reflections included in the refinement | 0.1033 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.088 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/1550433.html
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