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Information card for entry 8000379
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Coordinates | 8000379.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | AMU1 |
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Chemical name | Co(1,4-benzenedicarboxylate)(1,4-diazabicyclo[2.2.2]octane)H2O |
Formula | C14 H18 Co N2 O5 |
Calculated formula | C14 H18 Co N2 O5 |
Title of publication | Piezochromic Porous Metal-Organic Framework. |
Authors of publication | Andrzejewski, Michał; Katrusiak, Andrzej |
Journal of publication | The journal of physical chemistry letters |
Year of publication | 2017 |
Journal volume | 8 |
Journal issue | 1 |
Pages of publication | 279 - 284 |
a | 5.8059 ± 0.0011 Å |
b | 7.0187 ± 0.0007 Å |
c | 10.556 ± 0.003 Å |
α | 90.42 ± 0.02° |
β | 96.96 ± 0.03° |
γ | 95.048 ± 0.012° |
Cell volume | 425.26 ± 0.15 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 ± 2 K |
Number of distinct elements | 5 |
Space group number | 1 |
Hermann-Mauguin space group symbol | P 1 |
Hall space group symbol | P 1 |
Residual factor for all reflections | 0.2303 |
Residual factor for significantly intense reflections | 0.1713 |
Weighted residual factors for significantly intense reflections | 0.3955 |
Weighted residual factors for all reflections included in the refinement | 0.4355 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.521 |
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/8000379.html
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