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Information card for entry 1574089
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Coordinates | 1574089.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | salt [1](I)2 |
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Formula | C39 H42 I2 N6 O4 |
Calculated formula | C39 H42 I2 N6 O4 |
Title of publication | Fluoride-induced redox-switchable behaviour of a palladium (II)/(IV) couple |
Authors of publication | Martinez Vivas, Sebastian; Poyatos, Macarena; Peris, Eduardo |
Journal of publication | Chemical Science |
Year of publication | 2025 |
a | 14.2539 ± 0.0012 Å |
b | 17.2346 ± 0.0016 Å |
c | 17.3593 ± 0.0017 Å |
α | 106.528 ± 0.003° |
β | 102.26 ± 0.003° |
γ | 90.213 ± 0.003° |
Cell volume | 3985.7 ± 0.6 Å3 |
Cell temperature | 100 K |
Ambient diffraction temperature | 100 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0799 |
Residual factor for significantly intense reflections | 0.0706 |
Weighted residual factors for significantly intense reflections | 0.1776 |
Weighted residual factors for all reflections included in the refinement | 0.1843 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.088 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
298337 (current) | 2025-03-08 | cif/ Adding structures of 1574089, 1574090, 1574091 via cif-deposit CGI script. |
1574089.cif |
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Users of the data should acknowledge the original authors of the
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