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Information card for entry 7714461
Preview
Coordinates | 7714461.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | HIAM-4034 |
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Formula | C86 H75 N9 O35 S3 Zr6 |
Calculated formula | C86 H75 N9 O35 S3 Zr6 |
Title of publication | Carboxyl Position Directed Structure Diversity in Zirconium-Tricarboxylate Frameworks |
Authors of publication | Xia, Jun; Si, Jincheng; Zhou, Kang; Xia, Hai-Lun; Zhang, Jian; Xu, Yingqian; Wang, Lei; Liu, Xiao-Yuan |
Journal of publication | Dalton Transactions |
Year of publication | 2023 |
a | 32.5504 ± 0.0006 Å |
b | 32.5504 ± 0.0006 Å |
c | 40.8188 ± 0.0013 Å |
α | 90° |
β | 90° |
γ | 120° |
Cell volume | 37454.5 ± 1.5 Å3 |
Cell temperature | 193.15 K |
Ambient diffraction temperature | 193.15 K |
Number of distinct elements | 6 |
Space group number | 155 |
Hermann-Mauguin space group symbol | R 3 2 :H |
Hall space group symbol | R 3 2" |
Residual factor for all reflections | 0.0736 |
Residual factor for significantly intense reflections | 0.0481 |
Weighted residual factors for significantly intense reflections | 0.1206 |
Weighted residual factors for all reflections included in the refinement | 0.1336 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.982 |
Diffraction radiation wavelength | 1.34139 Å |
Diffraction radiation type | GaKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
Revision | Date | Message | Files |
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287598 (current) | 2023-11-15 | cif/ Adding structures of 7714460, 7714461 via cif-deposit CGI script. |
7714461.cif |
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