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Information card for entry 1100828
Preview
| Coordinates | 1100828.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C14 H14 Zr |
|---|---|
| Calculated formula | C14 H14 Zr |
| Title of publication | Reaction of 1-Zirconacyclopent-3-yne with "Zirconocene": Synthesis and Structure of Bimetallic 1,2,3-Butatriene Complexes |
| Authors of publication | Suzuki, Noriyuki; Watanabe, Takaaki; Iwasaki, Masakazu; Chihara, Teiji |
| Journal of publication | Organometallics |
| Year of publication | 2005 |
| Journal volume | 24 |
| Journal issue | 9 |
| Pages of publication | 2065 - 2069 |
| a | 12.115 ± 0.0004 Å |
| b | 9.2921 ± 0.0003 Å |
| c | 9.9839 ± 0.0002 Å |
| α | 90° |
| β | 91.525 ± 0.002° |
| γ | 90° |
| Cell volume | 1123.52 ± 0.05 Å3 |
| Cell temperature | 113.2 K |
| Number of distinct elements | 3 |
| Space group number | 9 |
| Hermann-Mauguin space group symbol | C 1 c 1 |
| Hall space group symbol | C -2yc |
| Residual factor for significantly intense reflections | 0.0242 |
| Weighted residual factors for all reflections included in the refinement | 0.0677 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.929 |
| Diffraction radiation wavelength | 0.7107 Å |
| Diffraction radiation type | MoKα |
| Duplicate of | 4060460 |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 210313 (current) | 2018-09-01 | cif/ Updating bibliography in entries 1100828-1100829, 4060460-4060461. Marking entries 1100828-1100829 as duplicates of entries 4060460-4060461. |
1100828.cif |
| 130149 | 2015-01-27 | cod/ (saulius@kolibris) Deriving Hall space group symbols for 12003 CIFs using the 'cif_filter --estimate-spacegroup' command. |
1100828.cif |
| 120677 | 2014-07-23 | cod/ (saulius@koala.ibt.lt) Adding 4906 DOIs identified by CodBot. |
1100828.cif |
| 35911 | 2012-02-28 | cif/ Reorganising ranges 1, 3, 5, 6 and 8 into a prefix-directory tree. |
1100828.cif |
| 966 | 2010-01-30 | cif/ Adding _cod_database_code tags to all COD entries. Adding tag description to the cif_cod.dic dictionary so that COD entries can be validated. |
1100828.cif |
| 259 | 2008-03-10 | 10 files corrected. 2 of them 1100680.cif and 1100930.cif contained more than one structure. Only the first one is kept, the other have been placed at my home directory. There are also files with duplicated bibliography. Email Salius about the best way to proceed with them. |
1100828.cif |
| 19 | 2008-01-26 | Changing all end-of-line codes from DOS style to UNIX style in all COD CIF files, for more convenient processing: In the cod/cif/ directory: ff \*.cif | xargs perl -i -pe 's/\r\n/\n/' |
1100828.cif |
| 14 | 2008-01-13 | Appending a header with SVN keywords, COD URL and copying policy to all COD CIF files. |
1100828.cif |
| 13 | 2008-01-13 | Setting the svn:keywords property to "Author Date Revision URL Id" for all CIF files in the cod/cif directory. |
1100828.cif |
| 1 | 2007-11-30 | Adding all .cif files from the COD, downloaded in a Cod.zip file on 2007.02.07 (and the same Cod.zip is downloadable today, on 2007.11.29) |
1100828.cif |
All data in the COD and the database itself are dedicated to the
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Users of the data should acknowledge the original authors of the
structural data.