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Information card for entry 1567978
Preview
Coordinates | 1567978.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C36 H72 P2 |
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Calculated formula | C36 H72 P2 |
Title of publication | Syntheses, homeomorphic and configurational isomerizations, and structures of macrocyclic aliphatic dibridgehead diphosphines; molecules that turn themselves inside out |
Authors of publication | Zhu, Yun; Stollenz, Michael; Zarcone, Samuel R.; Kharel, Sugam; Joshi, Hemant; Bhuvanesh, Nattamai; Reibenspies, Joseph H.; Gladysz, John A. |
Journal of publication | Chemical Science |
Year of publication | 2022 |
a | 9.2062 ± 0.0004 Å |
b | 9.321 ± 0.0004 Å |
c | 25.5135 ± 0.0011 Å |
α | 85.783 ± 0.002° |
β | 82.881 ± 0.002° |
γ | 60.977 ± 0.001° |
Cell volume | 1899.43 ± 0.14 Å3 |
Cell temperature | 110 K |
Ambient diffraction temperature | 110 K |
Number of distinct elements | 3 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0449 |
Residual factor for significantly intense reflections | 0.0414 |
Weighted residual factors for significantly intense reflections | 0.1038 |
Weighted residual factors for all reflections included in the refinement | 0.1063 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.046 |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/1567978.html
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structural data.