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Information card for entry 4325748
Preview
Coordinates | 4325748.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C80 H160 Br4 Cl2 N50 O66 Sr4 |
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Calculated formula | C80 H88 Br4.002 Cl2 N50 O51 Sr4 |
Title of publication | Difference of Coordination between Alkali- and Alkaline-Earth-Metal Ions to a Symmetrical α,α',δ,δ'-Tetramethylcucurbit[6]uril |
Authors of publication | Wen-Jian Chen; Da-Hai Yu; Xin Xiao; Yun-Qian Zhang; Qian-Jiang Zhu; Sai-Feng Xue; Zhu Tao; Gang Wei |
Journal of publication | Inorganic Chemistry |
Year of publication | 2011 |
Journal volume | 50 |
Pages of publication | 6956 - 6964 |
a | 10.6622 ± 0.0006 Å |
b | 13.18 ± 0.0008 Å |
c | 26.732 ± 0.0016 Å |
α | 87.093 ± 0.002° |
β | 80.497 ± 0.002° |
γ | 73.618 ± 0.002° |
Cell volume | 3554.6 ± 0.4 Å3 |
Cell temperature | 223 ± 2 K |
Ambient diffraction temperature | 223 ± 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 | 0.0879 |
Residual factor for significantly intense reflections | 0.062 |
Weighted residual factors for significantly intense reflections | 0.1763 |
Weighted residual factors for all reflections included in the refinement | 0.1905 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.11 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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The link is: https://www.crystallography.net/4325748.html
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