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Information card for entry 7049372
Preview
Coordinates | 7049372.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C39 H38 Cu N10 O6 |
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Calculated formula | C39 H38 Cu N10 O6 |
Title of publication | [9]aneN<sub>3</sub>-based fluorescent receptors for metal ion sensing, featuring urea and amide functional groups. |
Authors of publication | Garau, Alessandra; Bencini, Andrea; Blake, Alexander J.; Caltagirone, Claudia; Conti, Luca; Isaia, Francesco; Lippolis, Vito; Montis, Riccardo; Mariani, Palma; Scorciapino, Mariano Andrea |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2019 |
Journal volume | 48 |
Journal issue | 15 |
Pages of publication | 4949 - 4960 |
a | 16.8909 ± 0.0003 Å |
b | 10.8298 ± 0.0003 Å |
c | 39.2281 ± 0.0014 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 7175.8 ± 0.3 Å3 |
Cell temperature | 120 ± 2 K |
Ambient diffraction temperature | 120 ± 0.12 K |
Number of distinct elements | 5 |
Space group number | 61 |
Hermann-Mauguin space group symbol | P b c a |
Hall space group symbol | -P 2ac 2ab |
Residual factor for all reflections | 0.1031 |
Residual factor for significantly intense reflections | 0.0981 |
Weighted residual factors for significantly intense reflections | 0.2177 |
Weighted residual factors for all reflections included in the refinement | 0.2196 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.188 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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