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Information card for entry 4503535
Preview
| Coordinates | 4503535.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | unknown |
|---|---|
| Chemical name | unknown |
| Formula | C24 H20 N4 Na O10 Tb |
| Calculated formula | C24 H20 N4 Na O10 Tb |
| SMILES | [Tb]12345(OC(=O)c6[n]2cccc6)([O]([Na]([O]1C(=O)c1[n]5cccc1)O)C(=O)c1[n]3cccc1)OC(=O)c1[n]4cccc1.O |
| Title of publication | Polymorph Selective Growth of Sodium Tetrakis(2-pyridinecarboxylato) Lanthanides and Their Structure Sensitive Properties |
| Authors of publication | Hong, Jung Hoon; Oh, Yunghee; Kim, Youngmee; Kang, Sung Kwon; Choi, Jungkweon; Kim, Wan Seop; Lee, Jong In; Kim, Sung-Jin; Hur, Nam Hwi |
| Journal of publication | Crystal Growth & Design |
| Year of publication | 2008 |
| Journal volume | 8 |
| Journal issue | 4 |
| Pages of publication | 1364 |
| a | 12.5255 ± 0.0005 Å |
| b | 12.5255 ± 0.0005 Å |
| c | 59.758 ± 0.005 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 8119.3 ± 0.8 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 179 |
| Hermann-Mauguin space group symbol | P 65 2 2 |
| Hall space group symbol | P 65 2 (0 0 1) |
| Residual factor for all reflections | 0.0583 |
| Residual factor for significantly intense reflections | 0.0453 |
| Weighted residual factors for significantly intense reflections | 0.0692 |
| Weighted residual factors for all reflections included in the refinement | 0.0822 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.007 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 213925 (current) | 2019-03-01 | cif/ Moved the _audit_creation_method data item out of the loop in entries 1508200, 1516032, 1517834, 1548517, 1548518, 1548519, 1548520, 1548521, 1548522, 2014597, 2216152, 2241692, 4078301, 4081819, 4084531, 4105795, 4331477, 4336091, 4503532, 4503533, 4503534, 4503535, 7004275, 7004276, 7004277, 7004278, 7004279, 7004280, 7015244, 7055771, 7103304, 7115802, 7115804, 7115805, 7115806, 7153370 7212801. |
4503535.cif |
| 179569 | 2016-03-24 | cif/4/50/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/50/35. |
4503535.cif |
| 120110 | 2014-07-12 | Adding DOIs to range 4/50 structures. | 4503535.cif |
| 41613 | 2012-03-13 | ../uploads/cif-deposit/cod/cif Adding structures of 4503532, 4503533, 4503534, 4503535 via cif-deposit CGI script. |
4503535.cif |
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Users of the data should acknowledge the original authors of the
structural data.