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Information card for entry 7248061
Preview
Coordinates | 7248061.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C42 H38 Br4 |
---|---|
Calculated formula | C42 H38 Br4 |
Title of publication | Channel confinement and separation properties in an adaptive supramolecular framework using an adamantane tecton |
Authors of publication | Lutz, Nicholas; Bicknell, Josephine; Loya, Jesus Daniel; Reinheimer, Eric W.; Campillo-Alvarado, Gonzalo |
Journal of publication | CrystEngComm |
Year of publication | 2024 |
Journal volume | 26 |
Journal issue | 8 |
Pages of publication | 1067 - 1070 |
a | 7.1953 ± 0.0003 Å |
b | 25.4666 ± 0.0009 Å |
c | 10.1699 ± 0.0004 Å |
α | 90° |
β | 107.729 ± 0.004° |
γ | 90° |
Cell volume | 1775.03 ± 0.13 Å3 |
Cell temperature | 101 ± 2 K |
Ambient diffraction temperature | 101 ± 2 K |
Number of distinct elements | 3 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.0458 |
Residual factor for significantly intense reflections | 0.0374 |
Weighted residual factors for significantly intense reflections | 0.0644 |
Weighted residual factors for all reflections included in the refinement | 0.0665 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.034 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7248061.html
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Users of the data should acknowledge the original authors of the
structural data.