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Information card for entry 4102051
Preview
| Coordinates | 4102051.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | CIS-11 |
|---|---|
| Chemical name | catena-(undeca(N,N-Dibutylamine) bis(tripentacontasulfido-hepta-copper-octaicosa-indium)) |
| Formula | C88 H220 Cu7 In28 N11 S53 |
| Calculated formula | Cu6.46 In28.54 N59.4 S53 |
| Title of publication | Assembly of Supertetrahedral T5 Copper-Indium Sulfide Clusters into a Super-Supertetrahedron of Infinite Order |
| Authors of publication | Le Wang; Tao Wu; Fan Zuo; Xiang Zhao; Xianhui Bu; Jianzhong Wu; Pingyun Feng |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2010 |
| Journal volume | 132 |
| Pages of publication | 3283 - 3285 |
| a | 27.2249 ± 0.0011 Å |
| b | 27.2249 ± 0.0011 Å |
| c | 27.2249 ± 0.0011 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 20179 ± 1.4 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 216 |
| Hermann-Mauguin space group symbol | F -4 3 m |
| Hall space group symbol | F -4 2 3 |
| Residual factor for all reflections | 0.1346 |
| Residual factor for significantly intense reflections | 0.098 |
| Weighted residual factors for significantly intense reflections | 0.292 |
| Weighted residual factors for all reflections included in the refinement | 0.3683 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.083 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176467 (current) | 2016-02-16 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4. |
4102051.cif |
| 91935 | 2013-12-29 | cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs. |
4102051.cif |
| 34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4102051.cif |
| 24873 | 2011-09-08 | ../uploads/cif-deposit/cod/cif Adding structures of 4102051 via cif-deposit CGI script. |
4102051.cif |
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Users of the data should acknowledge the original authors of the
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