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Information card for entry 2019509
Preview
| Coordinates | 2019509.cif |
|---|---|
| Structure factors | 2019509.hkl |
| Original IUCr paper | HTML |
| Chemical name | Poly[[(μ~2~-4,4'-bipyridine)(μ~4~-naphthalene-1,4-dicarboxylato)(μ~2~-naphthalene-1,4-dicarboxylato)dizinc(II)] dimethylformamide monosolvate monohydrate] |
|---|---|
| Formula | C37 H29 N3 O10 Zn2 |
| Calculated formula | C37 H29 N3 O10 Zn2 |
| Title of publication | A twofold interpenetrating three-dimensional zinc‒organic framework built from naphthalene-1,4-dicarboxylate and 4,4'-bipyridine ligands |
| Authors of publication | Cui, Guo-Gen; Yang, Xiao-Xi; Yang, Jian-Ping |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 2014 |
| Journal volume | 70 |
| Journal issue | 5 |
| Pages of publication | 498 - 501 |
| a | 10.239 ± 0.002 Å |
| b | 12.191 ± 0.002 Å |
| c | 13.91 ± 0.003 Å |
| α | 94.6 ± 0.03° |
| β | 93.75 ± 0.03° |
| γ | 99.87 ± 0.03° |
| Cell volume | 1699.5 ± 0.6 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0792 |
| Residual factor for significantly intense reflections | 0.0566 |
| Weighted residual factors for significantly intense reflections | 0.1259 |
| Weighted residual factors for all reflections included in the refinement | 0.1375 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.048 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181865 (current) | 2016-04-06 | hkl/2/01/ (antanas@echidna) Adding IUCr specific svn headers to multiple entries in subrange 2/01/95. |
2019509.cif 2019509.hkl |
| 180863 | 2016-04-02 | cif/2/01/ (antanas@echidna) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/01/95. |
2019509.cif 2019509.hkl |
| 176760 | 2016-02-20 | cif/2/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/01. |
2019509.cif 2019509.hkl |
| 115936 | 2014-06-06 | cif/ Updating files of 2019509 Original log message: Adding full bibliography for 2019509.cif. |
2019509.cif 2019509.hkl |
| 111639 | 2014-04-25 | cif/ hkl/ Adding structures of 2019509 via cif-deposit CGI script. |
2019509.cif 2019509.hkl |
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Users of the data should acknowledge the original authors of the
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