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Information card for entry 2018349
Preview
| Coordinates | 2018349.cif |
|---|---|
| Structure factors | 2018349.hkl |
| Original IUCr paper | HTML |
| Chemical name | poly[μ~3~-succinato-calcium(II)] |
|---|---|
| Formula | C4 H4 Ca O4 |
| Calculated formula | C4 H4 Ca O4 |
| Title of publication | A new layered Ca‒succinate coordination polymer |
| Authors of publication | Mazaj, Matjaz; Kaucic, Venceslav; Golobic, Amalija; Zabukovec Logar, Natasa |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 2012 |
| Journal volume | 68 |
| Journal issue | 1 |
| Pages of publication | m4 - m6 |
| a | 5.886 ± 0.0001 Å |
| b | 11.2117 ± 0.0003 Å |
| c | 17.0754 ± 0.0004 Å |
| α | 90° |
| β | 95.945 ± 0.0015° |
| γ | 90° |
| Cell volume | 1120.78 ± 0.04 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 4 |
| 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 | 0.0446 |
| Residual factor for significantly intense reflections | 0.0348 |
| Weighted residual factors for significantly intense reflections | 0.0996 |
| Weighted residual factors for all reflections included in the refinement | 0.1086 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.993 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 180852 (current) | 2016-04-02 | cif/2/01/ (antanas@echidna) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/01/83. |
2018349.cif 2018349.hkl |
| 176435 | 2016-02-14 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries from ranges 1, 2. |
2018349.cif 2018349.hkl |
| 125873 | 2014-10-25 | cod/ (saulius@koala.ibt.lt) Adding DOIs to 1887 Acta Cryst. CIFs, their DOIs fetched using ACCE codes. |
2018349.cif 2018349.hkl |
| 88064 | 2013-08-29 | Adding _cod_database_fobs_code data item to all COD CIFs that have Fobs deposited and did not have this data item yet. | 2018349.cif 2018349.hkl |
| 34292 | 2012-02-14 | hkl/ Adding Fobs data for the recently deposited IUCr structures. |
2018349.cif 2018349.hkl |
| 32289 | 2012-02-08 | ../uploads/cif-deposit/cod/cif Adding structures of 2018349 via cif-deposit CGI script. |
2018349.cif |
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