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Information card for entry 4507228
Preview
Coordinates | 4507228.cif |
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Original paper (by DOI) | HTML |
Formula | C105 H95 N10 O20 Zn4 |
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Calculated formula | C105 H95 N10 O20 Zn4 |
Title of publication | Selective Adsorption Properties of Cationic Metal‒Organic Frameworks Based on Imidazolic Linker |
Authors of publication | Nickerl, Georg; Notzon, Andreas; Heitbaum, Maja; Senkovska, Irena; Glorius, Frank; Kaskel, Stefan |
Journal of publication | Crystal Growth & Design |
Year of publication | 2013 |
Journal volume | 13 |
Journal issue | 1 |
Pages of publication | 198 |
a | 12.036 ± 0.002 Å |
b | 16.838 ± 0.003 Å |
c | 40.383 ± 0.008 Å |
α | 90° |
β | 90.46 ± 0.03° |
γ | 90° |
Cell volume | 8184 ± 3 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 5 |
Space group number | 13 |
Hermann-Mauguin space group symbol | P 1 2/n 1 |
Hall space group symbol | -P 2yac |
Residual factor for all reflections | 0.0744 |
Residual factor for significantly intense reflections | 0.0483 |
Weighted residual factors for significantly intense reflections | 0.1097 |
Weighted residual factors for all reflections included in the refinement | 0.1139 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.991 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
179608 (current) | 2016-03-24 | cif/4/50/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/50/72. |
4507228.cif |
91935 | 2013-12-29 | cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs. |
4507228.cif |
73860 | 2013-02-21 | cif/ Adding structures of 4507228 via cif-deposit CGI script. |
4507228.cif |
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Users of the data should acknowledge the original authors of the
structural data.