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Information card for entry 2008982
Preview
Coordinates | 2008982.cif |
---|---|
Original IUCr paper | HTML |
Chemical name | Tricarbonyl{(R)-methyl 2,3-di-O-methyl-4,6-O-[(1S,3R)-(η^6^-3-trimethylsilyl phenyl)methylene]-α-D-glucopyranoside}chromium(0). |
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Formula | C22 H30 Cr O9 Si |
Calculated formula | C22 H30 Cr O9 Si |
SMILES | [Cr]([cH]12)([cH]13)([cH]21)([c]12[Si](C)(C)C)([cH]21)([c]13[C@H]3O[C@H]4[C@H](OC)[C@@H](OC)[C@@H](OC)O[C@@H]4CO3)(C#[O])(C#[O])C#[O] |
Title of publication | Tricarbonylchromium complexes of four methyl 4,6-<i>O</i>-[(η^6^-phenyl)alkylidene]-α-<small>D</small>-glucopyranosides |
Authors of publication | Rickard, Clifton E. F.; Singh, Yogendra; Woodgate, Paul D.; Zhao, Zhongde |
Journal of publication | Acta Crystallographica Section C |
Year of publication | 1999 |
Journal volume | 55 |
Journal issue | 9 |
Pages of publication | 1475 - 1479 |
a | 7.7051 ± 0.0002 Å |
b | 14.8671 ± 0.0003 Å |
c | 22.2079 ± 0.0005 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 2543.97 ± 0.1 Å3 |
Cell temperature | 203 ± 2 K |
Ambient diffraction temperature | 203 ± 2 K |
Number of distinct elements | 5 |
Space group number | 19 |
Hermann-Mauguin space group symbol | P 21 21 21 |
Hall space group symbol | P 2ac 2ab |
Residual factor for all reflections | 0.063 |
Residual factor for significantly intense reflections | 0.044 |
Weighted residual factors for all reflections included in the refinement | 0.091 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.095 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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