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Information card for entry 2232105
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| Coordinates | 2232105.cif |
|---|---|
| Structure factors | 2232105.hkl |
| Original IUCr paper | HTML |
| Chemical name | Poly[[aquatris(μ~4~-benzene-1,2-dicarboxylato)dilanthanum(III)] hemihydrate] |
|---|---|
| Formula | C48 H30 La4 O27 |
| Calculated formula | C48 H30 La4 O27 |
| Title of publication | Poly[[aquatris(μ~4~-benzene-1,2-dicarboxylato)dilanthanum(III)] hemihydrate] |
| Authors of publication | Lush, Shie Fu; Shen, Fwu Ming |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2011 |
| Journal volume | 67 |
| Journal issue | 10 |
| Pages of publication | m1370 - m1371 |
| a | 8.6269 ± 0.0019 Å |
| b | 10.5832 ± 0.0017 Å |
| c | 14.323 ± 0.002 Å |
| α | 97.271 ± 0.018° |
| β | 102.199 ± 0.006° |
| γ | 104.489 ± 0.008° |
| Cell volume | 1215.1 ± 0.4 Å3 |
| Cell temperature | 150 K |
| Ambient diffraction temperature | 150 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.048 |
| Residual factor for significantly intense reflections | 0.0366 |
| Weighted residual factors for significantly intense reflections | 0.0819 |
| Weighted residual factors for all reflections included in the refinement | 0.0865 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.108 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181243 (current) | 2016-04-03 | hkl/2/23/ (antanas@echidna) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/23/21. |
2232105.cif 2232105.hkl |
| 176798 | 2016-02-21 | cif/2/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/23. |
2232105.cif 2232105.hkl |
| 120072 | 2014-07-11 | Adding DOIs to range 2 structures. | 2232105.cif 2232105.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. | 2232105.cif 2232105.hkl |
| 29951 | 2011-11-08 | hkl/ Adding the most recent Fobs data from the IUCr journals. |
2232105.cif 2232105.hkl |
| 29399 | 2011-11-02 | ../uploads/cif-deposit/cod/cif Adding structures of 2232105 via cif-deposit CGI script. |
2232105.cif |
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Users of the data should acknowledge the original authors of the
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