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Information card for entry 2233887
Preview
Coordinates | 2233887.cif |
---|---|
Structure factors | 2233887.hkl |
Original IUCr paper | HTML |
Chemical name | {μ-5-[1,3-Bis(2,4,6-trimethylphenyl)-3<i>H</i>-imidazolium-2-yl]- 2-(2-oxoethenyl-1κ<i>C</i>^1^)furan-3-yl-2κ<i>C</i>^3^}-μ-hydrido- bis(tetracarbonylrhenium) tetrahydrofuran 0.67-solvate |
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Formula | C37.66 H31.33 N2 O10.67 Re2 |
Calculated formula | C37.664 H31.328 N2 O10.666 Re2 |
Title of publication | {μ-5-[1,3-Bis(2,4,6-trimethylphenyl)-3<i>H</i>-imidazolium-2-yl]-2-(2-oxoethenyl-1κ<i>C</i>^1^)furan-3-yl-2κ<i>C</i>^3^}-μ-hydrido-bis(tetracarbonylrhenium) tetrahydrofuran 0.67-solvate |
Authors of publication | Landman, Marilé; van der Westhuizen, Belinda; Bezuidenhout, Daniela I.; Liles, David C. |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2012 |
Journal volume | 68 |
Journal issue | 3 |
Pages of publication | m308 - m309 |
a | 12.7058 ± 0.0007 Å |
b | 13.8293 ± 0.0008 Å |
c | 13.9679 ± 0.0008 Å |
α | 60.76 ± 0.001° |
β | 77.68 ± 0.001° |
γ | 89.564 ± 0.001° |
Cell volume | 2078.8 ± 0.2 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0523 |
Residual factor for significantly intense reflections | 0.0418 |
Weighted residual factors for significantly intense reflections | 0.1239 |
Weighted residual factors for all reflections included in the refinement | 0.1368 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.155 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | Yes |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/2233887.html
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