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Information card for entry 7052502
Preview
Coordinates | 7052502.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C56 H44 Co2 O8 P4 |
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Calculated formula | C56 H44 Co2 O8 P4 |
SMILES | c1(ccccc1)[P](c1ccccc1)(CP(=O)(c1ccccc1)c1ccccc1)[Co](C#[O])(C#[O])(C#[O])[Co]([P](c1ccccc1)(c1ccccc1)CP(=O)(c1ccccc1)c1ccccc1)(C#[O])(C#[O])C#[O] |
Title of publication | Synthesis of cobalt-containing cyclophanes, and the formation of an unprecedented seven-membered cyclic diyneElectronic supplementary information (ESI) available: crystallographic data for complexes 8 and 11. See http://www.rsc.org/suppdata/nj/b3/b310515f/ |
Authors of publication | Golovko, Vladimir B.; Hope-Weeks, Louisa J.; Mays, Martin J.; McPartlin, Mary; Sloan, Anna M.; Woods, Anthony D. |
Journal of publication | New Journal of Chemistry |
Year of publication | 2004 |
Journal volume | 28 |
Journal issue | 4 |
Pages of publication | 527 |
a | 9.0167 ± 0.0006 Å |
b | 10.6153 ± 0.0008 Å |
c | 14.1165 ± 0.0012 Å |
α | 80.777 ± 0.003° |
β | 72.91 ± 0.005° |
γ | 89.329 ± 0.004° |
Cell volume | 1273.91 ± 0.17 Å3 |
Cell temperature | 180 ± 2 K |
Ambient diffraction temperature | 180 ± 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 | 0.1118 |
Residual factor for significantly intense reflections | 0.0535 |
Weighted residual factors for significantly intense reflections | 0.0951 |
Weighted residual factors for all reflections included in the refinement | 0.1162 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.996 |
Diffraction radiation wavelength | 0.71069 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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