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Information card for entry 2240534
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| Coordinates | 2240534.cif |
|---|---|
| Structure factors | 2240534.hkl |
| Original IUCr paper | HTML |
| Chemical name | [Bis(2,6-diisopropylphenyl) phosphato-κ<i>O</i>]tris(methanol-κ<i>O</i>)lithium methanol monosolvate |
|---|---|
| Formula | C28 H50 Li O8 P |
| Calculated formula | C28 H50 Li O8 P |
| Title of publication | Crystal structure of [bis(2,6-diisopropylphenyl) phosphato-κ<i>O</i>]tris(methanol-κ<i>O</i>)lithium methanol monosolvate |
| Authors of publication | Minyaev, Mikhail E.; Nifant'ev, Ilya E.; Tavtorkin, Alexander N.; Korchagina, Sof'ya A.; Zeynalova, Shadana Sh. |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2015 |
| Journal volume | 71 |
| Journal issue | 5 |
| Pages of publication | 443 - 446 |
| a | 11.1853 ± 0.0006 Å |
| b | 11.5046 ± 0.0006 Å |
| c | 14.5237 ± 0.0007 Å |
| α | 90.855 ± 0.002° |
| β | 102.859 ± 0.002° |
| γ | 118.683 ± 0.001° |
| Cell volume | 1582.21 ± 0.14 Å3 |
| Cell temperature | 123 ± 2 K |
| Ambient diffraction temperature | 123 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.05 |
| Residual factor for significantly intense reflections | 0.0395 |
| Weighted residual factors for significantly intense reflections | 0.1048 |
| Weighted residual factors for all reflections included in the refinement | 0.1115 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.024 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181905 (current) | 2016-04-06 | hkl/2/24/ (antanas@echidna) Adding IUCr specific svn headers to multiple entries in subrange 2/24/05 |
2240534.cif 2240534.hkl |
| 181325 | 2016-04-03 | hkl/2/24/ (antanas@echidna) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/24/05. |
2240534.cif 2240534.hkl |
| 176809 | 2016-02-21 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 2. |
2240534.cif 2240534.hkl |
| 171761 | 2015-12-30 | cod/ (antanas@echidna.ibt.lt) Removing _chemical_name_common tags with whitespace values from multiple entries in range 2. |
2240534.cif 2240534.hkl |
| 134588 | 2015-04-02 | cif/ hkl/ Adding structures of 2240534 via cif-deposit CGI script. |
2240534.cif 2240534.hkl |
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Users of the data should acknowledge the original authors of the
structural data.