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Information card for entry 8106806
Preview
| Coordinates | 8106806.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C22 H18 N2 O7 Zn |
|---|---|
| Calculated formula | C22 H18 N2 O7 Zn |
| Title of publication | Crystal structure of catena-poly[diaquabis(μ2-3-carboxybenzene-1,2-dicarboxylato-1:2κ2 O:O′)-(μ2-1,4-bis(2-ethylbenzimidazol-1-ylmethyl)-benzene-1:1′κ2 N:N′)dizinc(II)], [Zn2(C26H26N4)(C9H4O6)2(H2O)2] |
| Authors of publication | Xu, Chunying; Li, Jili; Lei, Song; Li, Shenshen; Su, Tong |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2016 |
| Journal volume | 231 |
| Journal issue | 1 |
| Pages of publication | 135 - 138 |
| a | 8.1731 ± 0.0016 Å |
| b | 8.715 ± 0.0017 Å |
| c | 15.396 ± 0.003 Å |
| α | 75.4 ± 0.03° |
| β | 79.26 ± 0.03° |
| γ | 71.82 ± 0.03° |
| Cell volume | 1001.3 ± 0.4 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 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 | 0.0345 |
| Residual factor for significantly intense reflections | 0.032 |
| Weighted residual factors for significantly intense reflections | 0.0768 |
| Weighted residual factors for all reflections included in the refinement | 0.0783 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.086 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 281236 (current) | 2023-03-02 | cif/ Adding structures of 8106806 via cif-deposit CGI script. |
8106806.cif |
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Users of the data should acknowledge the original authors of the
structural data.