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Information card for entry 7016574
Preview
| Coordinates | 7016574.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C50 H86 F12 N8 O14 Pd2 S4 Si4 |
|---|---|
| Calculated formula | C50 H86 F12 N8 O14 Pd2 S4 Si4 |
| Title of publication | Pseudorotaxane-type n-hydrocarbon container. Metallacyclodimer of ionic palladium(ii) complexes containing 1,3-bis(4-pyridyl)tetramethyldisiloxane. |
| Authors of publication | Ahn, Jungmin; Min Kim, Sung; Hwan Noh, Tae; Jung, Ok-Sang |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2011 |
| Journal volume | 40 |
| Journal issue | 34 |
| Pages of publication | 8520 - 8522 |
| a | 10.0994 ± 0.0002 Å |
| b | 13.5934 ± 0.0002 Å |
| c | 13.6673 ± 0.0003 Å |
| α | 96.268 ± 0.001° |
| β | 99.365 ± 0.001° |
| γ | 91.007 ± 0.001° |
| Cell volume | 1839.05 ± 0.06 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 8 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0384 |
| Residual factor for significantly intense reflections | 0.0345 |
| Weighted residual factors for significantly intense reflections | 0.0913 |
| Weighted residual factors for all reflections included in the refinement | 0.0945 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.028 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301847 (current) | 2025-08-21 | Add cross-references to PubChem compounds in COD range 7/01/ Each referenced PubChem compound corresponds to the full crystal structure. |
7016574.cif |
| 179869 | 2016-03-25 | cif/7/01/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/01/65. |
7016574.cif |
| 120112 | 2014-07-12 | Adding DOIs to range 7 structures. | 7016574.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7016574.cif |
| 27463 | 2011-10-03 | ../uploads/cif-deposit/cod/cif Adding structures of 7016573, 7016574, 7016575 via cif-deposit CGI script. |
7016574.cif |
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Users of the data should acknowledge the original authors of the
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