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Information card for entry 7214551
Preview
Coordinates | 7214551.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C42 H42 N6 O16 Zn2 |
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Calculated formula | C42 H30 N6 O16 Zn2 |
Title of publication | Controlling interpenetration in metal‒organic frameworks by tuning the conformations of flexible bis(triazole) ligands |
Authors of publication | He, Xiang; Lu, Xiao-Peng; Tian, Yu-Yang; Li, Ming-Xing; Zhu, Shourong; Xing, Feifei; Morris, Russell E. |
Journal of publication | CrystEngComm |
Year of publication | 2013 |
Journal volume | 15 |
Journal issue | 45 |
Pages of publication | 9437 |
a | 20.3296 ± 0.0018 Å |
b | 10.0183 ± 0.0009 Å |
c | 20.7795 ± 0.0019 Å |
α | 90° |
β | 103.925 ± 0.001° |
γ | 90° |
Cell volume | 4107.7 ± 0.6 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 ± 2 K |
Number of distinct elements | 5 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.0853 |
Residual factor for significantly intense reflections | 0.0602 |
Weighted residual factors for significantly intense reflections | 0.1417 |
Weighted residual factors for all reflections included in the refinement | 0.1617 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.072 |
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/7214551.html
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