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Information card for entry 7103787
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| Coordinates | 7103787.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | [Ca(thf){N(SiMe3)2}(MesNPPh2CHPPh2NMes)] |
|---|---|
| Formula | C53 H69 Ca N3 O P2 Si2 |
| Calculated formula | C53 H69 Ca N3 O P2 Si2 |
| Title of publication | Bis(phosphinimino)methyl derivatives of Ca, Sr and Ba: facile access to heavier alkaline earth organometallic chemistry. |
| Authors of publication | Michael Hill; Peter B. Hitchcock |
| Journal of publication | Chemical communications (Cambridge, England) |
| Year of publication | 2003 |
| a | 12.6861 ± 0.0006 Å |
| b | 22.9406 ± 0.0011 Å |
| c | 18.2982 ± 0.001 Å |
| α | 90° |
| β | 104.334 ± 0.002° |
| γ | 90° |
| Cell volume | 5159.5 ± 0.4 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 7 |
| 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 | 0.1741 |
| Residual factor for significantly intense reflections | 0.0892 |
| Weighted residual factors for significantly intense reflections | 0.1423 |
| Weighted residual factors for all reflections included in the refinement | 0.1722 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.098 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176453 (current) | 2016-02-16 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7. |
7103787.cif |
| 171654 | 2015-12-20 | cod/ (antanas@echidna.ibt.lt) Removing surrounding qoutes ("'") from the _chemical_name_common tag values in multiple entries in ranges 7, 8. |
7103787.cif |
| 120443 | 2014-07-15 | Adding 17924 DOIs guessed from source file names. | 7103787.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7103787.cif |
| 966 | 2010-01-30 | cif/ Adding _cod_database_code tags to all COD entries. Adding tag description to the cif_cod.dic dictionary so that COD entries can be validated. |
7103787.cif |
| 823 | 2009-09-25 | cif/ Depositing information from the Chem-Comm-2003_01-17 and J-Org-Chem-2007_13-20 publications. |
7103787.cif |
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Users of the data should acknowledge the original authors of the
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