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Information card for entry 2232058
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| Coordinates | 2232058.cif |
|---|---|
| Structure factors | 2232058.hkl |
| Original IUCr paper | HTML |
| Chemical name | Bis(triphenylphosphanylidene)iminium dichloridotriphenylstannate(IV) |
|---|---|
| Formula | C54 H45 Cl2 N P2 Sn |
| Calculated formula | C54 H45 Cl2 N P2 Sn |
| SMILES | c1(ccccc1)[P+](c1ccccc1)(c1ccccc1)N=P(c1ccccc1)(c1ccccc1)c1ccccc1.c1(ccccc1)[Sn](c1ccccc1)(c1ccccc1)(Cl)Cl |
| Title of publication | Bis(triphenylphosphanylidene)iminium dichloridotriphenylstannate(IV) |
| Authors of publication | De Lorentiis, Lucio; Graiff, Claudia; Predieri, Giovanni |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2011 |
| Journal volume | 67 |
| Journal issue | 10 |
| Pages of publication | m1356 |
| a | 17.9119 ± 0.0006 Å |
| b | 9.7744 ± 0.0003 Å |
| c | 13.3835 ± 0.0004 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 2343.16 ± 0.13 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 34 |
| Hermann-Mauguin space group symbol | P n n 2 |
| Hall space group symbol | P 2 -2n |
| Residual factor for all reflections | 0.0305 |
| Residual factor for significantly intense reflections | 0.0253 |
| Weighted residual factors for significantly intense reflections | 0.0623 |
| Weighted residual factors for all reflections included in the refinement | 0.0648 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.036 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181242 (current) | 2016-04-03 | hkl/2/23/ (antanas@echidna) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/23/20. |
2232058.cif 2232058.hkl |
| 176798 | 2016-02-21 | cif/2/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/23. |
2232058.cif 2232058.hkl |
| 120072 | 2014-07-11 | Adding DOIs to range 2 structures. | 2232058.cif 2232058.hkl |
| 88064 | 2013-08-29 | Adding _cod_database_fobs_code data item to all COD CIFs that have Fobs deposited and did not have this data item yet. | 2232058.cif 2232058.hkl |
| 29951 | 2011-11-08 | hkl/ Adding the most recent Fobs data from the IUCr journals. |
2232058.cif 2232058.hkl |
| 29351 | 2011-11-02 | ../uploads/cif-deposit/cod/cif Adding structures of 2232058 via cif-deposit CGI script. |
2232058.cif |
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Users of the data should acknowledge the original authors of the
structural data.