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Information card for entry 4063358
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Jmol._Canvas2D (Jmol) "jmolApplet0"[x]
Coordinates | 4063358.cif |
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Original paper (by DOI) | HTML |
Formula | C42 H66 Cl2 N5 P Ru |
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Calculated formula | C42 H66 Cl2 N5 P Ru |
SMILES | C(c1ccc(cc1)CN(C)C)=[Ru]([n]1ccc(cc1)N(C)C)([n]1ccc(cc1)N(C)C)([P](C1CCCCC1)(C1CCCCC1)C1CCCCC1)(Cl)Cl |
Title of publication | pH-Responsive Ruthenium-Based Olefin Metathesis Catalysts: Controlled Ring-Opening Metathesis Polymerization in Alcoholic and Aqueous Media upon Acid Addition |
Authors of publication | Dunbar, Miles A.; Balof, Shawna L.; Roberts, Adam N.; Valente, Edward J.; Schanz, Hans-Jörg |
Journal of publication | Organometallics |
Year of publication | 2011 |
Journal volume | 30 |
Journal issue | 2 |
Pages of publication | 199 - 203 |
a | 31.2038 ± 0.0012 Å |
b | 8.7691 ± 0.0003 Å |
c | 31.6887 ± 0.0014 Å |
α | 90° |
β | 91.144 ± 0.004° |
γ | 90° |
Cell volume | 8669.2 ± 0.6 Å3 |
Cell temperature | 298 ± 2 K |
Ambient diffraction temperature | 298 ± 2 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 | 0.1842 |
Residual factor for significantly intense reflections | 0.0355 |
Weighted residual factors for significantly intense reflections | 0.0487 |
Weighted residual factors for all reflections included in the refinement | 0.0594 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.596 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/4063358.html
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