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Information card for entry 8103073
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| Coordinates | 8103073.cif |
|---|
| Formula | C62 H68 Hg3 N10 O38 |
|---|---|
| Calculated formula | C62 H68 Hg3 N10 O38 |
| Title of publication | Crystal structure of 4,4'-bipyridinium bis(pyridine-2,6-dicarboxylato)mercurate(II) — diaquabis- (6-carboxypyridine-2-carboxylato)mercury(II) — water (2:1:12), [C10H10N2]2[Hg(C7H3NO4)2]2 · Hg(H2O)2(C7H4NO4)2 · 12H2O |
| Authors of publication | Hossein Aghabozorg; Sara Omidvar; Masoud Mirzaei; Behrouz Notash |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2011 |
| Journal volume | 226 |
| Journal issue | 1 |
| Pages of publication | 123 |
| a | 33.741 ± 0.007 Å |
| b | 9.3941 ± 0.0019 Å |
| c | 23.32 ± 0.005 Å |
| α | 90° |
| β | 104.26 ± 0.03° |
| γ | 90° |
| Cell volume | 7164 ± 3 Å3 |
| Cell temperature | 120 ± 2 K |
| Ambient diffraction temperature | 120 ± 2 K |
| Number of distinct elements | 5 |
| 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 | 0.0479 |
| Residual factor for significantly intense reflections | 0.0405 |
| Weighted residual factors for significantly intense reflections | 0.1071 |
| Weighted residual factors for all reflections included in the refinement | 0.1107 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.151 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 211175 (current) | 2018-09-26 | cif/ Removing _chemical_name_systematic and _chemical_name_common data items with placeholder values from 513 entries in range 8. |
8103073.cif |
| 176728 | 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 8. |
8103073.cif |
| 35911 | 2012-02-28 | cif/ Reorganising ranges 1, 3, 5, 6 and 8 into a prefix-directory tree. |
8103073.cif |
| 28974 | 2011-11-02 | ../uploads/cif-deposit/cod/cif Adding structures of 8103073 via cif-deposit CGI script. |
8103073.cif |
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Users of the data should acknowledge the original authors of the
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