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Information card for entry 7207964
Preview
Coordinates | 7207964.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C6 H2 Cu2 N2 O5 |
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Calculated formula | C6 H2 Cu2 N2 O5 |
Title of publication | Highly rigid and stable porous Cu(i) metal‒organic framework with reversible single-crystal-to-single-crystal structural transformation |
Authors of publication | Mohapatra, Sudip; Sato, Hiroshi; Matsuda, Ryotaro; Kitagawa, Susumu; Maji, Tapas Kumar |
Journal of publication | CrystEngComm |
Year of publication | 2012 |
Journal volume | 14 |
Journal issue | 12 |
Pages of publication | 4153 |
a | 19.3929 ± 0.001 Å |
b | 12.5914 ± 0.0006 Å |
c | 7.589 ± 0.0003 Å |
α | 90° |
β | 107.013 ± 0.002° |
γ | 90° |
Cell volume | 1772.02 ± 0.14 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 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 | 0.0918 |
Residual factor for significantly intense reflections | 0.0697 |
Weighted residual factors for significantly intense reflections | 0.1771 |
Weighted residual factors for all reflections included in the refinement | 0.1991 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.997 |
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/7207964.html
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structural data.