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Information card for entry 4134137
Preview
Coordinates | 4134137.cif |
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Original paper (by DOI) | HTML |
Formula | C407.65 H443.3 Cl1.3 N24 O67 |
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Calculated formula | C407.65 H443.3 Cl1.3 N24 O67 |
Title of publication | Aromatic Nanosandwich Obtained by σ-Dimerization of a Nanographenoid π-Radical. |
Authors of publication | Moshniaha, Liliia; Żyła-Karwowska, Marika; Chmielewski, Piotr J.; Lis, Tadeusz; Cybinska, Joanna; Gońka, Elżbieta; Oschwald, Johannes; Drewello, Thomas; Medina Rivero, Samara; Casado, Juan; Stępień, Marcin |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2020 |
a | 38.946 ± 0.019 Å |
b | 22.898 ± 0.004 Å |
c | 46.386 ± 0.009 Å |
α | 90° |
β | 103.52 ± 0.03° |
γ | 90° |
Cell volume | 40220 ± 2 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.3053 |
Residual factor for significantly intense reflections | 0.1414 |
Weighted residual factors for significantly intense reflections | 0.3047 |
Weighted residual factors for all reflections included in the refinement | 0.4219 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.148 |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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The link is: https://www.crystallography.net/4134137.html
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