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Information card for entry 7207124
Preview
| Coordinates | 7207124.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C55 H49 Ce F18 N4 O12 |
|---|---|
| Calculated formula | C55 H49 Ce F18 N4 O12 |
| SMILES | [Ce]123([O]=[N]4C(=N(=O)C(C4(C)C)(C)C)c4ccc(OCc5ccccc5)cc4)([O]=[N]4C(=N(=O)C(C4(C)C)(C)C)c4ccc(OCc5ccccc5)cc4)(OC(=CC(=[O]1)C(F)(F)F)C(F)(F)F)([O]=C(C(F)(F)F)C=C(O2)C(F)(F)F)OC(=CC(=[O]3)C(F)(F)F)C(F)(F)F |
| Title of publication | Linear chain and mononuclear tri-spin compounds based on the lanthanide-nitronyl nitroxide radicals: structural design and magnetic properties |
| Authors of publication | Wang, Ya-Li; Zhou, Na; Ma, Yue; Qin, Zi-Xuan; Wang, Qing-Lun; Li, Li-Cun; Cheng, Peng; Liao, Dai-Zheng |
| Journal of publication | CrystEngComm |
| Year of publication | 2012 |
| Journal volume | 14 |
| Journal issue | 1 |
| Pages of publication | 235 |
| a | 12.056 ± 0.002 Å |
| b | 15.736 ± 0.003 Å |
| c | 17.49 ± 0.004 Å |
| α | 73.04 ± 0.03° |
| β | 74.49 ± 0.03° |
| γ | 78.36 ± 0.03° |
| Cell volume | 3030.5 ± 1.2 Å3 |
| Cell temperature | 113 ± 2 K |
| Ambient diffraction temperature | 113 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0381 |
| Residual factor for significantly intense reflections | 0.0325 |
| Weighted residual factors for significantly intense reflections | 0.0702 |
| Weighted residual factors for all reflections included in the refinement | 0.0726 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.06 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 180402 (current) | 2016-03-26 | cif/7/20/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/20/71. |
7207124.cif |
| 120112 | 2014-07-12 | Adding DOIs to range 7 structures. | 7207124.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7207124.cif |
| 32484 | 2012-02-09 | ../uploads/cif-deposit/cod/cif Adding structures of 7207124, 7207125, 7207126, 7207127 via cif-deposit CGI script. |
7207124.cif |
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