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Information card for entry 1551910
Preview
Coordinates | 1551910.cif |
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Original paper (by DOI) | HTML |
Formula | C10 H8 Cu O5 |
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Calculated formula | C10 H8 Cu O5 |
Title of publication | Hydrolytic stability in hemilabile metal-organic frameworks |
Authors of publication | Lauren N. McHugh; Matthew J. McPherson; Laura J. McCormick; Samuel A. Morris; Paul S. Wheatley; Simon J. Teat; David McKay; Daniel M. Dawson; Charlotte E. F. Sansome; Sharon E. Ashbrook; Corinne A. Stone; Martin W. Smith; Russell E. Morris |
Journal of publication | Nature Chemistry |
Year of publication | 2018 |
Journal volume | 10 |
Pages of publication | 1096 - 1102 |
a | 33.028 ± 0.003 Å |
b | 33.028 ± 0.003 Å |
c | 5.2047 ± 0.0006 Å |
α | 90° |
β | 90° |
γ | 120° |
Cell volume | 4916.9 ± 0.8 Å3 |
Cell temperature | 300 ± 2 K |
Ambient diffraction temperature | 300 ± 2 K |
Number of distinct elements | 4 |
Space group number | 157 |
Hermann-Mauguin space group symbol | P 3 1 m |
Hall space group symbol | P 3 -2 |
Residual factor for all reflections | 0.1685 |
Residual factor for significantly intense reflections | 0.1515 |
Weighted residual factors for significantly intense reflections | 0.3291 |
Weighted residual factors for all reflections included in the refinement | 0.341 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.104 |
Diffraction radiation wavelength | 0.7749 Å |
Diffraction radiation type | synchrotron |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
Revision | Date | Message | Files |
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216575 (current) | 2019-06-26 | cif/ Adding structures of 1551910 via cif-deposit CGI script. |
1551910.cif |
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