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Information card for entry 7118743
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Coordinates | 7118743.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | Na6TBC[8](THF)7.(THF)5 |
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Formula | C136 H191 Na6 O20 |
Calculated formula | C136 H191 Na6 O20 |
Title of publication | Flexible macrocycles as versatile supports for catalytically active metal clusters. |
Authors of publication | Ryan, Jason D.; Gagnon, Kevin J.; Teat, Simon J.; McIntosh, Ruaraidh D. |
Journal of publication | Chemical communications (Cambridge, England) |
Year of publication | 2016 |
Journal volume | 52 |
Journal issue | 58 |
Pages of publication | 9071 - 9073 |
a | 17.7793 ± 0.0007 Å |
b | 18.0796 ± 0.0007 Å |
c | 22.8488 ± 0.0016 Å |
α | 83.835 ± 0.006° |
β | 84.664 ± 0.006° |
γ | 61.434 ± 0.004° |
Cell volume | 6405.9 ± 0.6 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 4 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1634 |
Residual factor for significantly intense reflections | 0.112 |
Weighted residual factors for significantly intense reflections | 0.3012 |
Weighted residual factors for all reflections included in the refinement | 0.3388 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.024 |
Diffraction radiation wavelength | 0.71075 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7118743.html
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