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Information card for entry 4070669
Preview
| Coordinates | 4070669.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C76 H102 B La N2 O4 |
|---|---|
| Calculated formula | C76 H102 B La N2 O4 |
| SMILES | [La]1([O]2CCCC2)([O]2CCCC2)([O]2CCCC2)([N](c2c(cccc2C(C)C)C(C)C)=C(N1c1c(cccc1C(C)C)C(C)C)C(C)(C)C)Cc1ccccc1.c1(ccccc1)[B-](c1ccccc1)(c1ccccc1)c1ccccc1.O1CCCC1 |
| Title of publication | Strategies for the Synthesis of Lanthanum Dialkyl Complexes with Monoanionic Ancillary Ligands |
| Authors of publication | Bambirra, Sergio; Perazzolo, Francesca; Boot, Steven J.; Sciarone, Timo J. J.; Meetsma, Auke; Hessen, Bart |
| Journal of publication | Organometallics |
| Year of publication | 2008 |
| Journal volume | 27 |
| Journal issue | 4 |
| Pages of publication | 704 |
| a | 21.148 ± 0.001 Å |
| b | 17.242 ± 0.001 Å |
| c | 18.497 ± 0.001 Å |
| α | 90° |
| β | 92.309 ± 0.001° |
| γ | 90° |
| Cell volume | 6739.2 ± 0.6 Å3 |
| Cell temperature | 100 ± 1 K |
| Ambient diffraction temperature | 100 ± 1 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 | 0.0713 |
| Residual factor for significantly intense reflections | 0.0575 |
| Weighted residual factors for significantly intense reflections | 0.129 |
| Weighted residual factors for all reflections included in the refinement | 0.1341 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.147 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 178595 (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 4/07/06. |
4070669.cif |
| 120075 | 2014-07-11 | Adding DOIs to range 4/07 structures. | 4070669.cif |
| 47256 | 2012-03-23 | cif/4/ Distributing the new range 4 CIFs into their appropriate prefixed subdirectories. |
4070669.cif |
| 42631 | 2012-03-13 | ../uploads/cif-deposit/cod/cif Adding structures of 4070669 via cif-deposit CGI script. |
4070669.cif |
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Users of the data should acknowledge the original authors of the
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