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Information card for entry 7110065
Preview
Coordinates | 7110065.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C36 H42 N4 O20 Zn3 |
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Calculated formula | C36 H37.5 N4 O20 Zn3 |
Title of publication | Incorporation by coordination and release of the iron chelator drug deferiprone from zinc-based metal-organic frameworks |
Authors of publication | Andrew D. Burrows; Monika Jurcic; Luke L. Keenan; Rebecca A. Lane; Mary F. Mahon; Mark R. Warren; Harriott Nowell; Michael Paradowski; John Spencer |
Journal of publication | Chem.Commun. |
Year of publication | 2013 |
Journal volume | 49 |
Pages of publication | 11260 |
a | 11.2503 ± 0.0001 Å |
b | 11.2503 ± 0.0001 Å |
c | 59.786 ± 0.0011 Å |
α | 90° |
β | 90° |
γ | 120° |
Cell volume | 6553.27 ± 0.15 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 5 |
Space group number | 179 |
Hermann-Mauguin space group symbol | P 65 2 2 |
Hall space group symbol | P 65 2 (0 0 1) |
Residual factor for all reflections | 0.0381 |
Residual factor for significantly intense reflections | 0.0345 |
Weighted residual factors for significantly intense reflections | 0.0741 |
Weighted residual factors for all reflections included in the refinement | 0.0758 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.006 |
Diffraction radiation wavelength | 0.6889 Å |
Diffraction radiation type | Synchrotron |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7110065.html
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