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Information card for entry 2022352
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| Coordinates | 2022352.cif |
|---|---|
| Structure factors | 2022352.hkl |
| Original IUCr paper | HTML |
| Chemical name | Aquadibenzylbis(4-{(<i>E</i>)-[(Z)-4-hydroxypent-3-en-2-ylidene]amino}benzoato)tin(IV) benzene disolvate |
|---|---|
| Formula | C50 H52 N2 O7 Sn |
| Calculated formula | C38 H40 N2 O7 Sn |
| SMILES | [Sn]12([O]=C(O1)c1ccc(N/C(=C\C(=O)C)C)cc1)([O]=C(O2)c1ccc(N/C(=C\C(=O)C)C)cc1)([OH2])(Cc1ccccc1)Cc1ccccc1 |
| Title of publication | Structural diversity among some dialkyltin(IV) benzoate and related derivatives |
| Authors of publication | Linden, Anthony; Basu Baul, Tushar S. |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 2021 |
| Journal volume | 77 |
| Journal issue | 5 |
| Pages of publication | 209 - 220 |
| a | 23.653 ± 0.0005 Å |
| b | 10.1034 ± 0.0002 Å |
| c | 20.5952 ± 0.0004 Å |
| α | 90° |
| β | 115.072 ± 0.0012° |
| γ | 90° |
| Cell volume | 4458.02 ± 0.16 Å3 |
| Cell temperature | 160 ± 2 K |
| Ambient diffraction temperature | 160 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0765 |
| Residual factor for significantly intense reflections | 0.0559 |
| Weighted residual factors for significantly intense reflections | 0.137 |
| Weighted residual factors for all reflections included in the refinement | 0.1483 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.047 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 266200 (current) | 2021-06-06 | cif/ Updating files of 2022350, 2022351, 2022352, 2022353, 2022354 Original log message: Adding full bibliography for 2022350--2022354.cif. |
2022352.cif 2022352.hkl |
| 264028 | 2021-04-10 | cif/ hkl/ Adding structures of 2022350, 2022351, 2022352, 2022353, 2022354 via cif-deposit CGI script. |
2022352.cif 2022352.hkl |
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Users of the data should acknowledge the original authors of the
structural data.