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Information card for entry 7711304
Preview
Coordinates | 7711304.cif |
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Original paper (by DOI) | HTML |
Formula | C116 H100 N20 O57 Ti12 |
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Calculated formula | C116 H100 N20 O57 Ti12 |
Title of publication | New Picolinate-Functionalized Titanium-Oxide Clusters: Syntheses, Structure and Photocatalytic H2 Evolution |
Authors of publication | Gao, Chang; Wang, Dexin; Liu, Yanshu; Zhang, Guanyun; Liu, Caiyun; Said, Amir; Niu, Huihui; Tung, Chen-Ho; Wang, Yifeng |
Journal of publication | Dalton Transactions |
Year of publication | 2022 |
a | 32.8178 ± 0.0007 Å |
b | 15.2483 ± 0.0003 Å |
c | 32.1138 ± 0.0008 Å |
α | 90° |
β | 114.021 ± 0.003° |
γ | 90° |
Cell volume | 14678.5 ± 0.7 Å3 |
Cell temperature | 173 K |
Ambient diffraction temperature | 173 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 | 0.1449 |
Residual factor for significantly intense reflections | 0.1097 |
Weighted residual factors for significantly intense reflections | 0.2974 |
Weighted residual factors for all reflections included in the refinement | 0.3261 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.908 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
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277988 (current) | 2022-09-20 | cif/ Adding structures of 7711303, 7711304 via cif-deposit CGI script. |
7711304.cif |
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Users of the data should acknowledge the original authors of the
structural data.