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Information card for entry 7124408
Preview
Coordinates | 7124408.cif |
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Original paper (by DOI) | HTML |
Formula | C45 H42 Cl Cu N4 O6 |
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Calculated formula | C45 H42 Cl Cu N4 O6 |
Title of publication | Chirality Transfer in a Cage Controls the Clockwise / Anticlockwise Propeller Arrangement of the tris(2-pyridylmethyl)amine Ligand |
Authors of publication | Martinez, Alexandre; Qiu, Gege; Colomban, Cédric; Giorgi, Michel; Vanthuyne, Nicolas |
Journal of publication | Chemical Communications |
Year of publication | 2019 |
a | 11.7718 ± 0.0007 Å |
b | 15.1157 ± 0.0008 Å |
c | 21.9868 ± 0.0014 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 3912.3 ± 0.4 Å3 |
Cell temperature | 293 K |
Ambient diffraction temperature | 293 K |
Number of distinct elements | 6 |
Space group number | 19 |
Hermann-Mauguin space group symbol | P 21 21 21 |
Hall space group symbol | P 2ac 2ab |
Residual factor for all reflections | 0.1155 |
Residual factor for significantly intense reflections | 0.0645 |
Weighted residual factors for significantly intense reflections | 0.1423 |
Weighted residual factors for all reflections included in the refinement | 0.1658 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.076 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
220575 (current) | 2019-10-31 | cif/ Adding structures of 7124407, 7124408, 7124409 via cif-deposit CGI script. |
7124408.cif |
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