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Information card for entry 7245916
Preview
Coordinates | 7245916.cif |
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Original paper (by DOI) | HTML |
Formula | C16 H16 N3 O5 Zn |
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Calculated formula | C13 H9 N2 O4 Zn |
Title of publication | Pillared MOFs: structure and ring opening polymerization of cyclic esters |
Authors of publication | Gong, Yi; Chen, Fei; Beamish-Cook, Jethro; Elsegood, Mark R. J.; Derbyshire, Max; Rowe, Oliver; Redshaw, Carl |
Journal of publication | CrystEngComm |
Year of publication | 2023 |
Journal volume | 25 |
Journal issue | 2 |
Pages of publication | 267 - 283 |
a | 16.112 ± 0.006 Å |
b | 7.649 ± 0.003 Å |
c | 29.1 ± 0.013 Å |
α | 90° |
β | 101.562 ± 0.005° |
γ | 90° |
Cell volume | 3514 ± 2 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 5 |
Space group number | 15 |
Hermann-Mauguin space group symbol | I 1 2/a 1 |
Hall space group symbol | -I 2ya |
Residual factor for all reflections | 0.0499 |
Residual factor for significantly intense reflections | 0.042 |
Weighted residual factors for significantly intense reflections | 0.1039 |
Weighted residual factors for all reflections included in the refinement | 0.1077 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.094 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
281437 (current) | 2023-03-04 | cif/ Updating files of 7245916 Original log message: Adding full bibliography for 7245916.cif. |
7245916.cif |
279572 | 2022-11-26 | cif/ Adding structures of 7245916 via cif-deposit CGI script. |
7245916.cif |
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