Crystallography Open Database  
  
  - COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 8106144
Preview
| Coordinates | 8106144.cif | 
|---|---|
| Original paper (by DOI) | HTML | 
| Formula | C28 H23 F N2 O3 Sn | 
|---|---|
| Calculated formula | C28 H23 F N2 O3 Sn | 
| SMILES | [Sn]12(OC(=N[N]2=Cc2c(O1)c(OCC)ccc2)c1ccc(F)cc1)(c1ccccc1)c1ccccc1 | 
| Title of publication | Crystal structure of (N-(3-ethoxy-2-oxidobenzylidene)-4-fluorobenzohydrazonato-κ3 N,O,O′)-diphenyltin(IV), C28H23FN2O3Sn | 
| Authors of publication | Tan, Yee Seng; Lee, See Mun; Tiekink, Edward R.T. | 
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures | 
| Year of publication | 2018 | 
| Journal volume | 233 | 
| Journal issue | 2 | 
| Pages of publication | 331 - 333 | 
| a | 16.0887 ± 0.0002 Å | 
| b | 14.5333 ± 0.0002 Å | 
| c | 20.555 ± 0.0002 Å | 
| α | 90° | 
| β | 90° | 
| γ | 90° | 
| Cell volume | 4806.21 ± 0.1 Å3 | 
| Cell temperature | 100 ± 2 K | 
| Ambient diffraction temperature | 100 ± 2 K | 
| Number of distinct elements | 6 | 
| Space group number | 61 | 
| Hermann-Mauguin space group symbol | P b c a | 
| Hall space group symbol | -P 2ac 2ab | 
| Residual factor for all reflections | 0.0224 | 
| Residual factor for significantly intense reflections | 0.0199 | 
| Weighted residual factors for significantly intense reflections | 0.0574 | 
| Weighted residual factors for all reflections included in the refinement | 0.0596 | 
| Goodness-of-fit parameter for all reflections included in the refinement | 1.015 | 
| Diffraction radiation wavelength | 1.54178 Å | 
| Diffraction radiation type | CuKα | 
| Has coordinates | Yes | 
| Has disorder | No | 
| Has Fobs | No | 
| Revision | Date | Message | Files | 
|---|---|---|---|
| 279364 (current) | 2022-11-17 | cif/ Adding structures of 8106144 via cif-deposit CGI script. | 8106144.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.