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Information card for entry 7006015
Preview
| Coordinates | 7006015.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C22 H62 B2 K2 O P2 Si4 |
|---|---|
| Calculated formula | C22 H62 B2 K2 O P2 Si4 |
| Title of publication | Alkali metal complexes of a phosphine-borane-stabilised carbanion: influence of co-ligands on structure. |
| Authors of publication | Izod, Keith; Wills, Corinne; Clegg, William; Harrington, Ross W. |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2007 |
| Journal issue | 33 |
| Pages of publication | 3669 - 3675 |
| a | 12.614 ± 0.002 Å |
| b | 13.3311 ± 0.0011 Å |
| c | 14.5257 ± 0.0016 Å |
| α | 115.522 ± 0.006° |
| β | 113.77 ± 0.011° |
| γ | 93.432 ± 0.008° |
| Cell volume | 1935 ± 0.5 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0582 |
| Residual factor for significantly intense reflections | 0.0373 |
| Weighted residual factors for significantly intense reflections | 0.1042 |
| Weighted residual factors for all reflections included in the refinement | 0.1183 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.132 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301846 (current) | 2025-08-21 | Add cross-references to PubChem compounds in COD range 7/00/ Each referenced PubChem compound corresponds to the full crystal structure. |
7006015.cif |
| 179764 | 2016-03-25 | cif/7/00/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/00/60. |
7006015.cif |
| 120443 | 2014-07-15 | Adding 17924 DOIs guessed from source file names. | 7006015.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7006015.cif |
| 1186 | 2010-06-03 | Adding CIFs from Chem-Comm-2010_20-22/ and Dalton-Trans-2007/ processing. | 7006015.cif |
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Users of the data should acknowledge the original authors of the
structural data.