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Information card for entry 7009842
Preview
| Coordinates | 7009842.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C104 H140 F12 N12 O6 P2 Ru2 |
|---|---|
| Calculated formula | C104 H140 F12 N12 O6 P2 Ru2 |
| Title of publication | Bis(R-bipyridyl)ruthenium bibenzimidazole complexes (R = H, Me or But): supramolecular arrangement via hydrogen bonds, photo- and electro-chemical properties and reactivity towards carbon dioxide |
| Authors of publication | Sven Rau; Mario Ruben; Torsten Büttner; Christian Temme; Sylvana Dautz; Helmar Görls; Manfred Rudolph; Dirk Walther; Andre Brodkorb; Marco Duati; Christine O'Connor; Johannes G. Vos |
| Journal of publication | J. Chem. Soc., Dalton Trans. |
| Year of publication | 2000 |
| Journal issue | 20 |
| Pages of publication | 3649 - 3657 |
| a | 12.3749 ± 0.0003 Å |
| b | 14.4512 ± 0.0004 Å |
| c | 16.6108 ± 0.0005 Å |
| α | 80.763 ± 0.002° |
| β | 88.971 ± 0.002° |
| γ | 75.717 ± 0.002° |
| Cell volume | 2840.67 ± 0.14 Å3 |
| Cell temperature | 183 ± 2 K |
| Ambient diffraction temperature | 183 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0855 |
| Residual factor for significantly intense reflections | 0.0635 |
| Weighted residual factors for significantly intense reflections | 0.1552 |
| Weighted residual factors for all reflections included in the refinement | 0.1686 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.081 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179802 (current) | 2016-03-25 | cif/7/00/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/00/98. |
7009842.cif |
| 120443 | 2014-07-15 | Adding 17924 DOIs guessed from source file names. | 7009842.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7009842.cif |
| 3896 | 2010-12-08 | cif/7/ Adding CIFs with data from Dalton-Trans-2004-2000/. |
7009842.cif |
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Users of the data should acknowledge the original authors of the
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