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Information card for entry 1518883
Preview
| Coordinates | 1518883.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C40 H62 Cl2 Cr N2 |
|---|---|
| Calculated formula | C40 H62 Cl2 Cr N2 |
| Title of publication | Cr(i)Cl as well as Cr+are stabilised between two cyclic alkyl amino carbenes |
| Authors of publication | Samuel, Prinson P.; Neufeld, Roman; Chandra Mondal, Kartik; Roesky, Herbert W.; Herbst-Irmer, Regine; Stalke, Dietmar; Demeshko, Serhiy; Meyer, Franc; Rojisha, Vallyanga Chalil; De, Susmita; Parameswaran, Pattiyil; Stückl, A. Claudia; Kaim, Wolfgang; Christian, Jonathan H.; Bindra, Jasleen K.; Dalal, Naresh S. |
| Journal of publication | Chem. Sci. |
| Year of publication | 2015 |
| Journal volume | 6 |
| Journal issue | 5 |
| Pages of publication | 3148 |
| a | 16.958 ± 0.003 Å |
| b | 10.973 ± 0.002 Å |
| c | 22.073 ± 0.005 Å |
| α | 90° |
| β | 108.91 ± 0.02° |
| γ | 90° |
| Cell volume | 3885.7 ± 1.4 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.033 |
| Residual factor for significantly intense reflections | 0.0277 |
| Weighted residual factors for significantly intense reflections | 0.0697 |
| Weighted residual factors for all reflections included in the refinement | 0.0727 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.058 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176729 (current) | 2016-02-18 | cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 1. |
1518883.cif |
| 138481 | 2015-06-07 | cif/ Updating files of 1518882, 1518883, 1518884 Original log message: Adding full bibliography for 1518882--1518884.cif. |
1518883.cif |
| 134226 | 2015-03-21 | cif/ Adding structures of 1518882, 1518883, 1518884 via cif-deposit CGI script. |
1518883.cif |
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Users of the data should acknowledge the original authors of the
structural data.