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Information card for entry 7207578
Preview
Coordinates | 7207578.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C19 H22 Ba N O11 S |
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Calculated formula | C19 H22 Ba N O11 S |
Title of publication | Guest-induced expanding and shrinking porous modulation based on interdigitated metal‒organic frameworks constructed by 4,4′-sulfonyldibenzoate and barium ions |
Authors of publication | Xiao, Dongrong; Chen, Haiyan; Sun, Dianzhen; He, Jianghong; Yan, Shiwei; Yang, Juan; Wang, Xin; Yuan, Ruo; Wang, Enbo |
Journal of publication | CrystEngComm |
Year of publication | 2012 |
Journal volume | 14 |
Journal issue | 8 |
Pages of publication | 2849 |
a | 6.3012 ± 0.0005 Å |
b | 14.0909 ± 0.001 Å |
c | 14.1544 ± 0.001 Å |
α | 113.043 ± 0.001° |
β | 91.63 ± 0.001° |
γ | 93.08 ± 0.001° |
Cell volume | 1153.14 ± 0.15 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 ± 2 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0277 |
Residual factor for significantly intense reflections | 0.0256 |
Weighted residual factors for significantly intense reflections | 0.0739 |
Weighted residual factors for all reflections included in the refinement | 0.0756 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.04 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/7207578.html
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