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Information card for entry 7123346
Preview
Coordinates | 7123346.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C166 H206 N2 Na6 O56 Si6 |
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Calculated formula | C163.305 H154.357 N1.747 Na6 O58.0395 Si6 |
Title of publication | Silane catecholates: Versatile tools for self-assembled dynamic covalent bond chemistry |
Authors of publication | Kabe, Yoshio; Kawakami, Yoshiteru; Ogishima, Tsuyoshi; Kawara, Tomoki; Yamauchi, Shota; Okamoto, Kazuhiko; Nikaido, Singo; Souma, Daiki; Jin, Ren-hua |
Journal of publication | Chemical Communications |
Year of publication | 2019 |
a | 19.998 ± 0.004 Å |
b | 34.746 ± 0.006 Å |
c | 24.908 ± 0.005 Å |
α | 90° |
β | 101.563 ± 0.003° |
γ | 90° |
Cell volume | 16956 ± 6 Å3 |
Cell temperature | 120 ± 2 K |
Ambient diffraction temperature | 120 ± 2 K |
Number of distinct elements | 6 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.1253 |
Residual factor for significantly intense reflections | 0.0964 |
Weighted residual factors for significantly intense reflections | 0.2547 |
Weighted residual factors for all reflections included in the refinement | 0.2819 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.082 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
Revision | Date | Message | Files |
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214830 (current) | 2019-04-30 | cif/ Adding structures of 7123344, 7123345, 7123346 via cif-deposit CGI script. |
7123346.cif |
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Users of the data should acknowledge the original authors of the
structural data.