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Information card for entry 4119854
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Coordinates | 4119854.cif |
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Original paper (by DOI) | HTML |
Formula | C57 H56 O10 Pd2 |
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Calculated formula | C57 H56 O10 Pd2 |
Title of publication | The Elusive Structure of Pd2(dba)3. Examination by Isotopic Labeling, NMR Spectroscopy, and X-ray Diffraction Analysis: Synthesis and Characterization of Pd2(dba-Z)3 Complexes |
Authors of publication | Anant R. Kapdi; Adrian C. Whitwood; David C. Williamson; Jason M. Lynam; Michael J. Burns; Thomas J. Williams; Alan J. Reay; Jordan Holmes; Ian J. S. Fairlamb |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2013 |
Journal volume | 135 |
Pages of publication | 8388 - 8399 |
a | 13.2832 ± 0.001 Å |
b | 17.4986 ± 0.0013 Å |
c | 21.4602 ± 0.0016 Å |
α | 90° |
β | 107.099 ± 0.002° |
γ | 90° |
Cell volume | 4767.7 ± 0.6 Å3 |
Cell temperature | 115 ± 2 K |
Ambient diffraction temperature | 115 K |
Number of distinct elements | 4 |
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 | 0.0944 |
Residual factor for significantly intense reflections | 0.0497 |
Weighted residual factors for significantly intense reflections | 0.1032 |
Weighted residual factors for all reflections included in the refinement | 0.1183 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.025 |
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/4119854.html
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