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Information card for entry 7236413
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| Coordinates | 7236413.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | Tripticene triacid |
|---|---|
| Formula | C22 H11 Mn N3 O6 |
| Calculated formula | C22 H11 Mn N3 O6 |
| Title of publication | Orthogonal self-assembly of a trigonal triptycene triacid: signaling of exfoliation of porous 2D metal‒organic layers by fluorescence and selective CO2 capture by the hydrogen-bonded MOF |
| Authors of publication | Chandrasekhar, Pujari; Mukhopadhyay, Arindam; Savitha, Govardhan; Moorthy, Jarugu Narasimha |
| Journal of publication | Journal of Materials Chemistry A |
| Year of publication | 2017 |
| Journal volume | 5 |
| Journal issue | 11 |
| Pages of publication | 5402 |
| a | 13.7763 ± 0.0011 Å |
| b | 40.73 ± 0.006 Å |
| c | 17.9835 ± 0.0014 Å |
| α | 90° |
| β | 101.209 ± 0.002° |
| γ | 90° |
| Cell volume | 9898.2 ± 1.8 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | I 1 2/a 1 |
| Hall space group symbol | -I 2ya |
| Residual factor for all reflections | 0.3694 |
| Residual factor for significantly intense reflections | 0.1177 |
| Weighted residual factors for significantly intense reflections | 0.3329 |
| Weighted residual factors for all reflections included in the refinement | 0.4213 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.958 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 235490 (current) | 2019-11-23 | cif/ Adding structures of 7236412, 7236413, 7236414, 7236415, 7236416 via cif-deposit CGI script. |
7236413.cif |
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Users of the data should acknowledge the original authors of the
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