Crystallography Open Database  
  
  - COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 8104841
Preview
| Coordinates | 8104841.cif | 
|---|---|
| Original paper (by DOI) | HTML | 
| Formula | C22 H24 Cl2 Mn N2 O8 | 
|---|---|
| Calculated formula | C22 H24 Cl2 Mn N2 O8 | 
| Title of publication | Crystal structure of (E)-2-chloro-6-(((1,3-dihydroxy-2-(oxidomethyl)propan-2-yl)imino)methyl)phenolate-κ3 N,O,O’)manganese(IV), C22H24Cl2MnN2O8 | 
| Authors of publication | Xu, Xindi; Wang, Xia; Tian, Hui; Wang, Man; Wu, Qiong | 
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures | 
| Year of publication | 2021 | 
| Journal volume | 236 | 
| Journal issue | 2 | 
| Pages of publication | 391 - 392 | 
| a | 11.0944 ± 0.0004 Å | 
| b | 18.2945 ± 0.0009 Å | 
| c | 11.9283 ± 0.0005 Å | 
| α | 90° | 
| β | 114.33 ± 0.0012° | 
| γ | 90° | 
| Cell volume | 2206.03 ± 0.16 Å3 | 
| Cell temperature | 150 K | 
| Ambient diffraction temperature | 150 K | 
| Number of distinct elements | 6 | 
| 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 | 0.0429 | 
| Residual factor for significantly intense reflections | 0.0305 | 
| Weighted residual factors for significantly intense reflections | 0.0716 | 
| Weighted residual factors for all reflections included in the refinement | 0.0791 | 
| Goodness-of-fit parameter for all reflections included in the refinement | 1.067 | 
| Diffraction radiation wavelength | 0.71073 Å | 
| Diffraction radiation type | MoKα | 
| Has coordinates | Yes | 
| Has disorder | No | 
| Has Fobs | No | 
| Revision | Date | Message | Files | 
|---|---|---|---|
| 273924 (current) | 2022-03-23 | cif/ Adding structures of 8104841 via cif-deposit CGI script. | 8104841.cif | 
          All data in the COD and the database itself are dedicated to the
          public domain and licensed under the
          
    CC0
    License
.
          Users of the data should acknowledge the original authors of the
          structural data.