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Information card for entry 1512703
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| Coordinates | 1512703.cif |
|---|
| Formula | C9 H7 Mn N O4 |
|---|---|
| Calculated formula | C9 H7 Mn N O4 |
| Title of publication | Synthesis, crystal structures and properties of two complexes constructed from in situ-generated new ligands |
| Authors of publication | Hai-Jun Xu; Li Xu |
| Journal of publication | Inorganica Chimica Acta |
| Year of publication | 2012 |
| Journal volume | 393 |
| Pages of publication | 140 - 145 |
| a | 14.637 ± 0.003 Å |
| b | 7.5356 ± 0.0015 Å |
| c | 8.7567 ± 0.0018 Å |
| α | 90° |
| β | 101.04 ± 0.03° |
| γ | 90° |
| Cell volume | 948 ± 0.3 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0703 |
| Residual factor for significantly intense reflections | 0.0615 |
| Weighted residual factors for significantly intense reflections | 0.1543 |
| Weighted residual factors for all reflections included in the refinement | 0.1599 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.098 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176729 (current) | 2016-02-18 | cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 1. |
1512703.cif |
| 90770 | 2013-11-18 | cif/ Adding structures of 1512703 via cif-deposit CGI script. |
1512703.cif |
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Users of the data should acknowledge the original authors of the
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