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Information card for entry 8000528
Preview
| Coordinates | 8000528.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C44 H38 Br4 Mn P2 |
|---|---|
| Calculated formula | C44 H38 Br4 Mn P2 |
| Title of publication | Photoluminescence Behavior of Zero-Dimensional Manganese Halide Tetrahedra Embedded in Conjugated Organic Matrices |
| Authors of publication | Fu, Pengfei; Sun, Yuling; Xia, Zhiguo; Xiao, Zewen |
| Journal of publication | The Journal of Physical Chemistry Letters |
| Year of publication | 2021 |
| Pages of publication | 7394 - 7399 |
| a | 11.90232 ± 0.00004 Å |
| b | 18.92658 ± 0.00007 Å |
| c | 18.74628 ± 0.00008 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 4222.98 ± 0.03 Å3 |
| Cell temperature | 249.97 ± 0.1 K |
| Ambient diffraction temperature | 249.97 ± 0.1 K |
| Number of distinct elements | 5 |
| Space group number | 60 |
| Hermann-Mauguin space group symbol | P b c n |
| Hall space group symbol | -P 2n 2ab |
| Residual factor for all reflections | 0.028 |
| Residual factor for significantly intense reflections | 0.0271 |
| Weighted residual factors for significantly intense reflections | 0.0679 |
| Weighted residual factors for all reflections included in the refinement | 0.0685 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.085 |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 267835 (current) | 2021-07-31 | cif/ Adding structures of 8000528 via cif-deposit CGI script. |
8000528.cif |
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Users of the data should acknowledge the original authors of the
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