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Information card for entry 4122437
Preview
Coordinates | 4122437.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C184.5 H94.5 B9 Br9 F36 N18 O9 Pd4.5 |
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Calculated formula | C184.5 H94.5 B9 Br9 F36 N18 O9 Pd4.5 |
Title of publication | Emergent Ion-Gated Binding of Cationic Host-Guest Complexes within Cationic M12L24 Molecular Flasks. |
Authors of publication | Bruns, Carson J.; Fujita, Daishi; Hoshino, Manabu; Sato, Sota; Stoddart, J. Fraser; Fujita, Makoto |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2014 |
Journal volume | 136 |
Journal issue | 34 |
Pages of publication | 12027 |
a | 63.138 ± 0.0003 Å |
b | 63.138 ± 0.0003 Å |
c | 41.609 ± 0.0003 Å |
α | 90° |
β | 90° |
γ | 120° |
Cell volume | 143648 ± 1.4 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 8 |
Space group number | 148 |
Hermann-Mauguin space group symbol | R -3 :H |
Hall space group symbol | -R 3 |
Residual factor for all reflections | 0.2598 |
Residual factor for significantly intense reflections | 0.2139 |
Weighted residual factors for significantly intense reflections | 0.4951 |
Weighted residual factors for all reflections included in the refinement | 0.5207 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.976 |
Diffraction radiation wavelength | 0.75 Å |
Diffraction radiation type | synchrotron |
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/4122437.html
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