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Information card for entry 1571908
Preview
Coordinates | 1571908.cif |
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Original paper (by DOI) | HTML |
Formula | C64 H78 Al N6 O3 P |
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Calculated formula | C64 H78 Al N6 O3 P |
Title of publication | Nitrogen monoxide and calix[4]pyrrolato aluminate: structural constraint enabled NO dimerization. |
Authors of publication | Kohl, Senta J.; Sigmund, Lukas M.; Schmitt, Manuel; Greb, Lutz |
Journal of publication | Chemical science |
Year of publication | 2024 |
Journal volume | 15 |
Journal issue | 28 |
Pages of publication | 10803 - 10809 |
a | 11.8687 ± 0.0017 Å |
b | 27.971 ± 0.004 Å |
c | 21.374 ± 0.003 Å |
α | 90° |
β | 95.254 ± 0.005° |
γ | 90° |
Cell volume | 7065.9 ± 1.7 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 6 |
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 | 0.0953 |
Residual factor for significantly intense reflections | 0.0699 |
Weighted residual factors for significantly intense reflections | 0.1782 |
Weighted residual factors for all reflections included in the refinement | 0.1949 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.04 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
293743 (current) | 2024-08-05 | cif/ Updating files of 1571908, 1571909 Original log message: Adding full bibliography for 1571908--1571909.cif. |
1571908.cif |
292429 | 2024-06-18 | cif/ Adding structures of 1571908, 1571909 via cif-deposit CGI script. |
1571908.cif |
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