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Information card for entry 2021527
Preview
Coordinates | 2021527.cif |
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Structure factors | 2021527.hkl |
Original IUCr paper | HTML |
Chemical name | Poly[[bis(nitrato-κ^2^<i>O</i>,<i>O</i>')cadmium(II)]-μ~3~-2,4,6-tris(pyridin-4-yl)-1,3,5-triazine-κ^3^<i>N</i>^2^:<i>N</i>^4^:<i>N</i>^6^] |
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Formula | C18 H12 Cd N8 O6 |
Calculated formula | C18 H12 Cd N8 O6 |
Title of publication | A fourfold interpenetrating cadmium(II) metal‒organic framework based on 2,4,6-tris(pyridin-4-yl)-1,3,5-triazine with reversible photochromic properties |
Authors of publication | Liu, Jian-Jun; Li, Li-Zhi; Chen, Chun-Ping; Wei, Jin-Zhong; Cheng, Fei-Xiang |
Journal of publication | Acta Crystallographica Section C |
Year of publication | 2019 |
Journal volume | 75 |
Journal issue | 3 |
Pages of publication | 372 - 377 |
a | 27.1721 ± 0.0015 Å |
b | 9.7995 ± 0.0006 Å |
c | 16.3477 ± 0.0009 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 4353 ± 0.4 Å3 |
Cell temperature | 153 ± 2 K |
Ambient diffraction temperature | 153 ± 2 K |
Number of distinct elements | 5 |
Space group number | 60 |
Hermann-Mauguin space group symbol | P b c n |
Hall space group symbol | -P 2n 2ab |
Residual factor for all reflections | 0.0403 |
Residual factor for significantly intense reflections | 0.0294 |
Weighted residual factors for significantly intense reflections | 0.0671 |
Weighted residual factors for all reflections included in the refinement | 0.0717 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.033 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | Yes |
Revision | Date | Message | Files |
---|---|---|---|
213876 (current) | 2019-02-27 | cif/ hkl/ Adding structures of 2021527 via cif-deposit CGI script. |
2021527.cif 2021527.hkl |
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Users of the data should acknowledge the original authors of the
structural data.