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Information card for entry 7029365
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Coordinates | 7029365.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | MonoOxaCu2 |
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Formula | C198 H268 Cu4 N8 O23 |
Calculated formula | C197.68 H257.36 Cu4 N8 O22.98 |
Title of publication | Oxacalix[4]arene-supported di-, tetra- and undecanuclear copper(ii) clusters. |
Authors of publication | Fairbairn, Robyn E.; McLellan, Ross; McIntosh, Ruaraidh D.; Palacios, Maria A.; Brechin, Euan K.; Dalgarno, Scott J. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2014 |
Journal volume | 43 |
Journal issue | 14 |
Pages of publication | 5292 - 5298 |
a | 16.02 ± 0.03 Å |
b | 17.8 ± 0.03 Å |
c | 19.23 ± 0.04 Å |
α | 113.17 ± 0.04° |
β | 95.82 ± 0.04° |
γ | 106.81 ± 0.04° |
Cell volume | 4679 ± 15 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1487 |
Residual factor for significantly intense reflections | 0.0734 |
Weighted residual factors for significantly intense reflections | 0.1734 |
Weighted residual factors for all reflections included in the refinement | 0.2071 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.029 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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