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Information card for entry 4516732
Preview
Coordinates | 4516732.cif |
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Original paper (by DOI) | HTML |
Formula | C23.5 H20 Cl2 N5 O2 Ru |
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Calculated formula | C23.5 H20 Cl2 N5 O2 Ru |
Title of publication | Hydrogenative Carbon Dioxide Reduction Catalyzed by Mononuclear Ruthenium Polypyridyl Complexes: Discerning between Electronic and Steric Effects |
Authors of publication | Ono, Takashi; Qu, Shuanglin; Gimbert-Suriñach, Carolina; Johnson, Michelle A.; Marell, Daniel J.; Benet-Buchholz, Jordi; Cramer, Christopher J.; Llobet, Antoni |
Journal of publication | ACS Catalysis |
Year of publication | 2017 |
Journal volume | 7 |
Journal issue | 9 |
Pages of publication | 5932 |
a | 9.0731 ± 0.0006 Å |
b | 10.4974 ± 0.0008 Å |
c | 12.7753 ± 0.001 Å |
α | 98.387 ± 0.003° |
β | 102.017 ± 0.003° |
γ | 101.29 ± 0.003° |
Cell volume | 1144.77 ± 0.15 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 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 | 0.0608 |
Residual factor for significantly intense reflections | 0.0576 |
Weighted residual factors for significantly intense reflections | 0.1541 |
Weighted residual factors for all reflections included in the refinement | 0.1589 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.03 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4516732.html
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