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Information card for entry 4130294
Preview
Coordinates | 4130294.cif |
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Original paper (by DOI) | HTML |
Formula | C60 H44 N4 O8 |
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Calculated formula | C60 H44 N4 O8 |
Title of publication | Directing the Crystallization of Dehydro[24]annulenes into Supramolecular Nanotubular Scaffolds. |
Authors of publication | Suzuki, Mitsuharu; Kotyk, Juliet F Khosrowabadi; Khan, Saeed I.; Rubin, Yves |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2016 |
Journal volume | 138 |
Journal issue | 18 |
Pages of publication | 5939 - 5956 |
a | 21.686 ± 0.009 Å |
b | 4.784 ± 0.002 Å |
c | 27.556 ± 0.013 Å |
α | 90° |
β | 102.913 ± 0.01° |
γ | 90° |
Cell volume | 2787 ± 2 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 4 |
Space group number | 5 |
Hermann-Mauguin space group symbol | C 1 2 1 |
Hall space group symbol | C 2y |
Residual factor for all reflections | 0.0994 |
Residual factor for significantly intense reflections | 0.0754 |
Weighted residual factors for significantly intense reflections | 0.1932 |
Weighted residual factors for all reflections included in the refinement | 0.2067 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.04 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
240779 (current) | 2019-11-25 | cif/ Adding structures of 4130285, 4130286, 4130287, 4130288, 4130289, 4130290, 4130291, 4130292, 4130293, 4130294, 4130295, 4130296, 4130297, 4130298 via cif-deposit CGI script. |
4130294.cif |
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Users of the data should acknowledge the original authors of the
structural data.