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Information card for entry 4079018
Preview
| Coordinates | 4079018.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C44 H78 N3 O3 Si2 Sm |
|---|---|
| Calculated formula | C44 H78 N3 O3 Si2 Sm |
| SMILES | [Sm]123(N([Si](C)(C)C)[Si](C)(C)C)(Oc4c(cc(cc4C[N]42CC[N]3(CC4)Cc2c(O1)c(cc(c2)C(C)(C)C)C(C)(C)C)C(C)(C)C)C(C)(C)C)[O]1CCCC1 |
| Title of publication | Control of Conformations of Piperazidine-Bridged Bis(phenolato) Groups: Syntheses and Structures of Bimetallic and Monometallic Lanthanide Amides and Their Application in the Polymerization of Lactides |
| Authors of publication | Li, Wenyi; Zhang, Zhongjian; Yao, Yingming; Zhang, Yong; Shen, Qi |
| Journal of publication | Organometallics |
| Year of publication | 2012 |
| Journal volume | 31 |
| Journal issue | 9 |
| Pages of publication | 3499 |
| a | 15.1517 ± 0.0018 Å |
| b | 28.82 ± 0.004 Å |
| c | 11.9193 ± 0.0015 Å |
| α | 90° |
| β | 110.833 ± 0.004° |
| γ | 90° |
| Cell volume | 4864.5 ± 1.1 Å3 |
| Cell temperature | 223 ± 2 K |
| Ambient diffraction temperature | 223 ± 2 K |
| Number of distinct elements | 6 |
| 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 | 0.0837 |
| Residual factor for significantly intense reflections | 0.0686 |
| Weighted residual factors for significantly intense reflections | 0.1312 |
| Weighted residual factors for all reflections included in the refinement | 0.1383 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.164 |
| Diffraction radiation wavelength | 0.71075 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 178679 (current) | 2016-03-21 | cif/4/07/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/07/90. |
4079018.cif |
| 91935 | 2013-12-29 | cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs. |
4079018.cif |
| 72285 | 2013-01-21 | cif/ Adding structures of 4079013, 4079014, 4079015, 4079016, 4079017, 4079018, 4079019, 4079020, 4079021, 4079022, 4079023 via cif-deposit CGI script. |
4079018.cif |
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Users of the data should acknowledge the original authors of the
structural data.