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Information card for entry 7104539
Preview
Coordinates | 7104539.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C69 H106 Cl5 Cu2 N8 O8 |
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Calculated formula | C69.02 H106.04 Cl5.02 Cu2 N8 O8 |
Title of publication | Anion-induced contraction of helical receptors. |
Authors of publication | Wenzel, Marco; Jameson, Geoffrey B; Ferguson, Lauren A; Knapp, Quintin W; Forgan, Ross S; White, Fraser J; Parsons, Simon; Tasker, Peter A; Plieger, Paul G |
Journal of publication | Chemical communications (Cambridge, England) |
Year of publication | 2009 |
Journal volume | 34 |
Journal issue | 24 |
Pages of publication | 3606 - 3608 |
a | 26.318 ± 0.005 Å |
b | 22.685 ± 0.004 Å |
c | 13.388 ± 0.003 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 7993 ± 3 Å3 |
Cell temperature | 150 K |
Ambient diffraction temperature | 150 K |
Number of distinct elements | 6 |
Space group number | 33 |
Hermann-Mauguin space group symbol | P n a 21 |
Hall space group symbol | P 2c -2n |
Residual factor for all reflections | 0.0881 |
Residual factor for significantly intense reflections | 0.0865 |
Weighted residual factors for significantly intense reflections | 0.1967 |
Weighted residual factors for all reflections included in the refinement | 0.1977 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.212 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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structural data.