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Information card for entry 2243540
Preview
Coordinates | 2243540.cif |
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Structure factors | 2243540.hkl |
Original paper (by DOI) | HTML |
Chemical name | Bis(pyridinium) diaquadipyridinehexakis[μ~3~-salicylhydroximato(3-)]bis[μ~2~-salicylhydroximato(1-)]hexaaluminiumytterbium‒pyridine‒water (1/7.386/1) |
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Formula | C119.02 H104.02 Al6 N20.2 O30 Yb |
Calculated formula | C119.02 H104.02 Al6 N20.204 O30 Yb |
Title of publication | Crystal structures of three anionic lanthanide‒aluminium [3.3.1] metallacryptate complexes |
Authors of publication | Rheam, Rachel E.; Zeller, Matthias; Zaleski, Curtis M. |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2020 |
Journal volume | 76 |
Journal issue | 9 |
Pages of publication | 1458 - 1466 |
a | 13.7254 ± 0.0006 Å |
b | 16.0597 ± 0.0008 Å |
c | 28.2523 ± 0.0012 Å |
α | 80.5334 ± 0.0016° |
β | 83.7992 ± 0.0017° |
γ | 72.0307 ± 0.0017° |
Cell volume | 5832.2 ± 0.5 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0644 |
Residual factor for significantly intense reflections | 0.0483 |
Weighted residual factors for significantly intense reflections | 0.1171 |
Weighted residual factors for all reflections included in the refinement | 0.1255 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.035 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | Yes |
Revision | Date | Message | Files |
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255341 (current) | 2020-08-15 | cif/ hkl/ Adding structures of 2243538, 2243539, 2243540 via cif-deposit CGI script. |
2243540.cif 2243540.hkl |
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Users of the data should acknowledge the original authors of the
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