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Information card for entry 2229884
Preview
| Coordinates | 2229884.cif |
|---|---|
| Structure factors | 2229884.hkl |
| Original IUCr paper | HTML |
| Common name | bis[1-(3-ammoniopropyl)-1H-imidazolium] decaiodotriplumbate(II) |
|---|---|
| Chemical name | <i>catena</i>-poly[bis[1-(3-ammoniopropyl)-1<i>H</i>-imidazolium] [[iodidoplumbate(II)]-tri-μ-iodido-plumbate(II)-tri-μ-iodido- [iodidoplumbate(II)]-di-μ-iodido]] |
| Formula | C12 H26 I10 N6 Pb3 |
| Calculated formula | C12 H26 I10 N6 Pb3 |
| SMILES | [Pb]1(I)([I][Pb](I)([I]1)[I][Pb](I)(I)(I)(I)[I][Pb]1(I)[I][Pb](I)([I]1)I)[I][Pb](I)(I)(I)I.n1(c[nH+]cc1)CCC[NH3+].n1(c[nH+]cc1)CCC[NH3+].n1(c[nH+]cc1)CCC[NH3+].n1(c[nH+]cc1)CCC[NH3+] |
| Title of publication | The one-dimensional organic‒inorganic hybrid: <i>catena</i>-poly[bis[1-(3-ammoniopropyl)-1<i>H</i>-imidazolium] [[iodidoplumbate(II)]-tri-μ-iodido-plumbate(II)-tri-μ-iodido-[iodidoplumbate(II)]-di-μ-iodido]] |
| Authors of publication | Trigui, A.; Boughzala, H.; Driss, A.; Abid, Y. |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2011 |
| Journal volume | 67 |
| Journal issue | 4 |
| Pages of publication | m458 - m459 |
| a | 8.652 ± 0.003 Å |
| b | 11.728 ± 0.005 Å |
| c | 11.972 ± 0.006 Å |
| α | 117.21 ± 0.03° |
| β | 98.05 ± 0.02° |
| γ | 107.17 ± 0.03° |
| Cell volume | 976.7 ± 0.9 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 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 | 0.0646 |
| Residual factor for significantly intense reflections | 0.0363 |
| Weighted residual factors for significantly intense reflections | 0.0972 |
| Weighted residual factors for all reflections included in the refinement | 0.1099 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.015 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181219 (current) | 2016-04-03 | hkl/2/22/ (antanas@echidna) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/22/98. |
2229884.cif 2229884.hkl |
| 176789 | 2016-02-20 | cif/2/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/22. |
2229884.cif 2229884.hkl |
| 120072 | 2014-07-11 | Adding DOIs to range 2 structures. | 2229884.cif 2229884.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. | 2229884.cif 2229884.hkl |
| 26848 | 2011-09-28 | cif/2/, hkl/2/, html/ Reorganising CIFs of the range 2* into the "prefix-directory" tree. |
2229884.cif 2229884.hkl |
| 19531 | 2011-05-17 | hkl/2/ Adding Fobs data for the latest IUCr deposition. |
2229884.cif 2229884.hkl |
| 19363 | 2011-05-06 | ../uploads/cif-deposit/cod/cif Adding structures of 2229884 via cif-deposit CGI script. |
2229884.cif |
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