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Information card for entry 7231665
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Coordinates | 7231665.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C319 H608 N16 O197 Ti32 |
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Calculated formula | C202 H266 N16 O138 Ti32 |
Title of publication | Single-crystal-to-single-crystal desolvation in a Ti32 nanoring cluster |
Authors of publication | Wang, Xiangxiang; Gui, Daxiang; Zhai, Fuwan; Li, Hui; Wang, Xia; Wang, Yanlong; Chen, Lanhua; Zheng, Tao; Chai, Zhifang; Wang, Shuao |
Journal of publication | CrystEngComm |
Year of publication | 2018 |
Journal volume | 20 |
Journal issue | 44 |
Pages of publication | 7062 |
a | 21.009 ± 0.01 Å |
b | 23.513 ± 0.015 Å |
c | 44.73 ± 0.02 Å |
α | 81.041 ± 0.012° |
β | 79.236 ± 0.006° |
γ | 66.339 ± 0.011° |
Cell volume | 19802 ± 18 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 2 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1187 |
Residual factor for significantly intense reflections | 0.0895 |
Weighted residual factors for significantly intense reflections | 0.2524 |
Weighted residual factors for all reflections included in the refinement | 0.2795 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.048 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7231665.html
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Users of the data should acknowledge the original authors of the
structural data.