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Information card for entry 4511749
Preview
| Coordinates | 4511749.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C18 H13 Gd N4 O9 |
|---|---|
| Calculated formula | C18 H13 Gd N4 O9 |
| Title of publication | Spontaneous Resolution in Homochiral Helical [Ln(nic)2(Hnic)(NO3)] Coordination Polymers Constructed from a Rigid Non-chiral Organic Ligand |
| Authors of publication | Mihalcea, Ionut; Zill, Nicolas; Mereacre, Valeriu; Anson, Christopher E.; Powell, Annie K. |
| Journal of publication | Crystal Growth & Design |
| Year of publication | 2014 |
| Journal volume | 14 |
| Journal issue | 9 |
| Pages of publication | 4729 |
| a | 11.1905 ± 0.0003 Å |
| b | 11.1905 ± 0.0003 Å |
| c | 26.6938 ± 0.0015 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 2894.9 ± 0.2 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 169 |
| Hermann-Mauguin space group symbol | P 61 |
| Hall space group symbol | P 61 |
| Residual factor for all reflections | 0.0166 |
| Residual factor for significantly intense reflections | 0.0166 |
| Weighted residual factors for significantly intense reflections | 0.0393 |
| Weighted residual factors for all reflections included in the refinement | 0.0393 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.042 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 211332 (current) | 2018-10-05 | cif/ Fixing enumeration values for CIF data items _atom_sites_solution_* using cif_fix_values. Data item relocations and exclusion of CIF comment lines might have occurred due to the usage of cif_filter. |
4511749.cif |
| 179664 | 2016-03-24 | cif/4/51/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/51/17. |
4511749.cif |
| 122844 | 2014-09-06 | cif/ Updating files of 4511749, 4511750, 4511751 Original log message: Adding full bibliography for 4511749--4511751.cif. |
4511749.cif |
| 122183 | 2014-08-19 | cif/ Adding structures of 4511749 via cif-deposit CGI script. |
4511749.cif |
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Users of the data should acknowledge the original authors of the
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