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Information card for entry 1572404
Preview
| Coordinates | 1572404.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C46 H26 Cl4 N4 O4 |
|---|---|
| Calculated formula | C46 H26 Cl4 N4 O4 |
| Title of publication | Triptycene-like naphthopleiadene as a readily accessible scaffold for supramolecular and materials chemistry. |
| Authors of publication | Amin, Md Khairul; Ye, Chunchun; Pang, Shuhua; Liu, Yuancheng; Taylor, Dominic; Nichol, Gary S.; McKeown, Neil B. |
| Journal of publication | Chemical science |
| Year of publication | 2024 |
| Journal volume | 15 |
| Journal issue | 36 |
| Pages of publication | 14968 - 14976 |
| a | 10.0081 ± 0.0003 Å |
| b | 14.3562 ± 0.0005 Å |
| c | 14.6779 ± 0.0004 Å |
| α | 63.466 ± 0.003° |
| β | 75.953 ± 0.002° |
| γ | 81.918 ± 0.002° |
| Cell volume | 1829.09 ± 0.11 Å3 |
| Cell temperature | 120 ± 0.1 K |
| Ambient diffraction temperature | 120 ± 0.1 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 | 0.0617 |
| Residual factor for significantly intense reflections | 0.0486 |
| Weighted residual factors for significantly intense reflections | 0.1118 |
| Weighted residual factors for all reflections included in the refinement | 0.1204 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.036 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 295182 (current) | 2024-10-06 | cif/ Updating files of 1572402, 1572403, 1572404, 1572405, 1572406, 1572407 Original log message: Adding full bibliography for 1572402--1572407.cif. |
1572404.cif |
| 294244 | 2024-08-29 | cif/ Adding structures of 1572402, 1572403, 1572404, 1572405, 1572406, 1572407 via cif-deposit CGI script. |
1572404.cif |
All data in the COD and the database itself are dedicated to the
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.
Users of the data should acknowledge the original authors of the
structural data.