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Information card for entry 4071389
Preview
| Coordinates | 4071389.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C21 H36 Cl4 O6 P2 Pt |
|---|---|
| Calculated formula | C20.3559 H34.8474 Cl3.9322 O5.7966 P1.9322 Pt |
| Title of publication | General Routes to Alkyl Phosphatrioxaadamantane Ligands |
| Authors of publication | Downing, Joanne H.; Floure, Joëlle; Heslop, Katie; Haddow, Mairi F.; Hopewell, Jonathan; Lusi, Matteo; Phetmung, Hirahataya; Orpen, A. Guy; Pringle, Paul G.; Pugh, Robert I.; Zambrano-Williams, Damaris |
| Journal of publication | Organometallics |
| Year of publication | 2008 |
| Journal volume | 27 |
| Journal issue | 13 |
| Pages of publication | 3216 |
| a | 12.0568 ± 0.0004 Å |
| b | 21.1776 ± 0.0006 Å |
| c | 12.7975 ± 0.0004 Å |
| α | 90° |
| β | 114.415 ± 0.004° |
| γ | 90° |
| Cell volume | 2975.43 ± 0.19 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 9 |
| Hermann-Mauguin space group symbol | C 1 c 1 |
| Hall space group symbol | C -2yc |
| Residual factor for all reflections | 0.0343 |
| Residual factor for significantly intense reflections | 0.0274 |
| Weighted residual factors for significantly intense reflections | 0.0566 |
| Weighted residual factors for all reflections included in the refinement | 0.0578 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.014 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 198633 (current) | 2017-07-11 | cod/ (melanie@ameba.ibt.lt) Correcting the '_refine_ls_hydrogen_treatment' data item 'constr' enumeration values with the help of the cif_fix_values script from the cod-tools package revision 5455. The following command was used : cif_fix_values --fix-misspelled src/cod-tools/trunk/data/replacement-values/replacement_values.lst $i | cif_filter --no-exclude-publication-details -h $i | sponge $i A total of 700 files were changed. |
4071389.cif |
| 178602 | 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 4/07/13. |
4071389.cif |
| 120075 | 2014-07-11 | Adding DOIs to range 4/07 structures. | 4071389.cif |
| 47256 | 2012-03-23 | cif/4/ Distributing the new range 4 CIFs into their appropriate prefixed subdirectories. |
4071389.cif |
| 43177 | 2012-03-13 | ../uploads/cif-deposit/cod/cif Adding structures of 4071389 via cif-deposit CGI script. |
4071389.cif |
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Users of the data should acknowledge the original authors of the
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