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Information card for entry 4068568
Preview
Coordinates | 4068568.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C40 H27 B Cl2 N17 P Ru |
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Calculated formula | C40 H27 B Cl2 N17 P Ru |
SMILES | [BH]12n3ccc[n]3[Ru]([n]3cccn13)([n]1cccn21)(n1nnc(C(=C(C#N)C#N)C#N)n1)([N]#CC(=C(C#N)C#N)C#N)[P](c1ccccc1)(c1ccccc1)c1ccccc1.C(Cl)Cl |
Title of publication | Synthesis and Reactivity of Ruthenium Azido Complexes Containing a Hydridotris(pyrazolyl)borate Ligand and Dimerization of Terminal Alkynes in Organic and Aqueous Media |
Authors of publication | Chen, Chien-Kai; Tong, Hung-Chun; Chen Hsu, Chih-Yung; Lee, Chia-Yi; Fong, Yih Hsuan; Chuang, Yao-Shun; Lo, Yih-Hsing; Lin, Ying-Chih; Wang, Yu |
Journal of publication | Organometallics |
Year of publication | 2009 |
Journal volume | 28 |
Journal issue | 12 |
Pages of publication | 3358 |
a | 16.0435 ± 0.0012 Å |
b | 13.2513 ± 0.0012 Å |
c | 21.3258 ± 0.0017 Å |
α | 90° |
β | 110.051 ± 0.005° |
γ | 90° |
Cell volume | 4259 ± 0.6 Å3 |
Cell temperature | 200 ± 2 K |
Ambient diffraction temperature | 200 ± 2 K |
Number of distinct elements | 7 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.1557 |
Residual factor for significantly intense reflections | 0.0668 |
Weighted residual factors for significantly intense reflections | 0.1328 |
Weighted residual factors for all reflections included in the refinement | 0.1669 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.003 |
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/4068568.html
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Users of the data should acknowledge the original authors of the
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