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Information card for entry 4513652
Preview
| Coordinates | 4513652.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | cis-dibromido(methyl-4,6-O-benzylidene-2,3-diamino-2,3-dideoxy-alpha-D-glucopyranoside)palladium(II) |
|---|---|
| Formula | C14.75 H21.5 Br2 Cl1.5 N2 O4 Pd |
| Calculated formula | C14.75 H21.5 Br2 Cl1.5 N2 O4 Pd |
| Title of publication | One-Step Preparation and Crystallization of Almost Insoluble Palladium(II) and Platinum(II/IV) Complexes from a Biphasic Solvent System |
| Authors of publication | Böge, Matthias; Heck, Jürgen |
| Journal of publication | Crystal Growth & Design |
| Year of publication | 2015 |
| Journal volume | 15 |
| Journal issue | 11 |
| Pages of publication | 5280 |
| a | 15.7679 ± 0.0001 Å |
| b | 15.7679 ± 0.0001 Å |
| c | 32.7215 ± 0.0005 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 8135.44 ± 0.14 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 96 |
| Hermann-Mauguin space group symbol | P 43 21 2 |
| Hall space group symbol | P 4nw 2abw |
| Residual factor for all reflections | 0.0362 |
| Residual factor for significantly intense reflections | 0.0298 |
| Weighted residual factors for significantly intense reflections | 0.0642 |
| Weighted residual factors for all reflections included in the refinement | 0.0666 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.045 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176429 (current) | 2016-02-13 | cif/ (antanas@kurmis) Replacing _cod_chemical_formula_sum_orig tag with _cod_original_formula_sum tag in multiple entries since the replaced tag is deprecated according to the COD CIF dictionary. |
4513652.cif |
| 176428 | 2016-02-13 | Replaced deprecated COD CIF data names with their more modern alternatives. The _cod_cif_authors_sg_Hall and _cod_cif_authors_sg_H-M data items were renamed to _cod_original_sg_symbol_Hall and _cod_cif_authors_sg_H-M respectively. |
4513652.cif |
| 171491 | 2015-12-13 | cif/ (antanas@echidna.ibt.lt) Removing surrounding qoutes ("'") from the _chemical_name_systematic tag values in multiple entries in range 4. |
4513652.cif |
| 170052 | 2015-11-06 | cif/ Updating files of 4513649, 4513650, 4513651, 4513652 Original log message: Adding full bibliography for 4513649--4513652.cif. |
4513652.cif |
| 159521 | 2015-10-02 | cif/ Adding structures of 4513649, 4513650, 4513651, 4513652 via cif-deposit CGI script. |
4513652.cif |
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