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Information card for entry 1571189
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Coordinates | 1571189.cif |
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Original paper (by DOI) | HTML |
Common name | Di-tert-butyldiphosphatetrahedrane |
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Formula | C10 H18 P2 |
Calculated formula | C10 H18 P2 |
Title of publication | Structure and photochemistry of di-<i>tert</i>-butyldiphosphatetrahedrane. |
Authors of publication | Hierlmeier, Gabriele; Kutta, Roger Jan; Coburger, Peter; Stammler, Hans-Georg; Schwabedissen, Jan; Mitzel, Norbert W.; Dimitrova, Maria; Berger, Raphael J. F.; Nuernberger, Patrick; Wolf, Robert |
Journal of publication | Chemical science |
Year of publication | 2024 |
Journal volume | 15 |
Journal issue | 15 |
Pages of publication | 5596 - 5603 |
a | 6.148 ± 0.0004 Å |
b | 11.2791 ± 0.0007 Å |
c | 8.6416 ± 0.0006 Å |
α | 90° |
β | 98.935 ± 0.006° |
γ | 90° |
Cell volume | 591.97 ± 0.07 Å3 |
Cell temperature | 94 ± 0.1 K |
Ambient diffraction temperature | 94 ± 0.1 K |
Number of distinct elements | 3 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.0369 |
Residual factor for significantly intense reflections | 0.027 |
Weighted residual factors for significantly intense reflections | 0.0542 |
Weighted residual factors for all reflections included in the refinement | 0.0555 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.839 |
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/1571189.html
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