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Information card for entry 4060214
Preview
| Coordinates | 4060214.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C27 H33 P Zr2 |
|---|---|
| Calculated formula | C27 H33 P Zr2 |
| Title of publication | Synthesis and Structure of 1-Zirconacyclopent-3-yne Complexes without Substituents Adjacent to the Triple Bond |
| Authors of publication | Noriyuki Suzuki; Naoto Aihara; Hidemichi Takahara; Takaaki Watanabe; Masakazu Iwasaki; Masahiko Saburi; Daisuke Hashizume; Teiji Chihara |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2004 |
| Journal volume | 126 |
| Pages of publication | 60 - 61 |
| a | 10.5259 ± 0.0002 Å |
| b | 33.0858 ± 0.0004 Å |
| c | 8.2256 ± 0.0001 Å |
| α | 90° |
| β | 105.661 ± 0.0005° |
| γ | 90° |
| Cell volume | 2758.28 ± 0.07 Å3 |
| Cell temperature | 200.2 K |
| Number of distinct elements | 4 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for significantly intense reflections | 0.0409 |
| Weighted residual factors for all reflections included in the refinement | 0.1316 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.707 |
| Diffraction radiation wavelength | 0.7107 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
Version history
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Users of the data should acknowledge the original authors of the
structural data.