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Information card for entry 7052132
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Coordinates | 7052132.cif |
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Original paper (by DOI) | HTML |
Chemical name | 1-[(1R,2S,5R)‒(‒)‒menthoxymethyl]-3-propylimidazolium chloride hemihydrate |
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Formula | C17 H32 Cl N2 O1.5 |
Calculated formula | C17 H32 Cl N2 O1.5 |
Title of publication | Synthesis and properties of chiral imidazolium ionic liquids with a (1R,2S,5R)-(?)-menthoxymethyl substituent |
Authors of publication | Juliusz Pernak; Joanna Feder-Kubis; Anna Cieniecka-Rosłonkiewicz; Cedric Fischmeister; Scott T. Griffin; Robin D. Rogers |
Journal of publication | New Journal of Chemistry |
Year of publication | 2007 |
Journal volume | 31 |
Journal issue | 6 |
Pages of publication | 879 |
a | 9.4408 ± 0.001 Å |
b | 34.119 ± 0.004 Å |
c | 12.1754 ± 0.0013 Å |
α | 90° |
β | 90.292 ± 0.002° |
γ | 90° |
Cell volume | 3921.8 ± 0.7 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 2 K |
Number of distinct elements | 5 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.1361 |
Residual factor for significantly intense reflections | 0.0651 |
Weighted residual factors for significantly intense reflections | 0.1222 |
Weighted residual factors for all reflections included in the refinement | 0.1471 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.99 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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