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Information card for entry 7048212
Preview
Coordinates | 7048212.cif |
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Original paper (by DOI) | HTML |
Formula | C77.01 H67.02 Ag4 F12 N16 O25 S4 |
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Calculated formula | C77.011 H67.022 Ag4 F12 N16 O25 S4 |
Title of publication | Exploring the reversible host-guest chemistry of a crystalline octanuclear Ag(i) metallosupramolecular macrocycle formed from a simple pyrazinylpyridine ligand. |
Authors of publication | Dalton, Hannah L.; Lynes, Amy D.; Twamley, Brendan; Byrne, Kevin; Schmitt, Wolfgang; Hawes, Chris S.; Gunnlaugsson, Thorfinnur |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2018 |
Journal volume | 47 |
Journal issue | 48 |
Pages of publication | 17266 - 17275 |
a | 12.499 ± 0.002 Å |
b | 15.145 ± 0.003 Å |
c | 25.237 ± 0.005 Å |
α | 103.55 ± 0.004° |
β | 93.043 ± 0.006° |
γ | 92.9 ± 0.007° |
Cell volume | 4628 ± 1.5 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 7 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1364 |
Residual factor for significantly intense reflections | 0.0746 |
Weighted residual factors for significantly intense reflections | 0.1969 |
Weighted residual factors for all reflections included in the refinement | 0.2478 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.031 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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