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Information card for entry 4107629
Preview
| Coordinates | 4107629.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C34 H25 N O2 |
|---|---|
| Calculated formula | C34.002 H25.005 N O2 |
| Title of publication | Light-Controlled Supramolecular Helicity of a Liquid Crystalline Phase Using a Helical Polymer Functionalized with a Single Chiroptical Molecular Switch |
| Authors of publication | Dirk Pijper; Mahthild G. M. Jongejan; Auke Meetsma; Ben L. Feringa |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2008 |
| Journal volume | 130 |
| Pages of publication | 4541 - 4552 |
| a | 9.1089 ± 0.0013 Å |
| b | 13.2614 ± 0.0018 Å |
| c | 19.958 ± 0.003 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 2410.9 ± 0.6 Å3 |
| Cell temperature | 100 ± 1 K |
| Ambient diffraction temperature | 100 ± 1 K |
| Number of distinct elements | 4 |
| Space group number | 19 |
| Hermann-Mauguin space group symbol | P 21 21 21 |
| Hall space group symbol | P 2ac 2ab |
| Residual factor for all reflections | 0.0586 |
| Residual factor for significantly intense reflections | 0.0461 |
| Weighted residual factors for significantly intense reflections | 0.0954 |
| Weighted residual factors for all reflections included in the refinement | 0.0997 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.068 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 178822 (current) | 2016-03-21 | cif/4/10/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/10/76. |
4107629.cif |
| 132410 | 2015-02-25 | cod/ (robertas@burundukas) Replaced zero-length value of the tag '_chemical_name_systematic' with '?'. codsql 'select file, chemname from data \ where length(chemname) = 0' -NB \ | perl -ne 'print $1."\n" if /\b(\d{7})\s*$/' \ | codid2file \ | xargs perl -0777 -i -pe 's/\b_chemical_name_systematic \K \s*? ( \n ; \s*? \n ; | '\'' \s* '\'' \s*? ) (?=\n) /" " x8 . "?"/ixmse' |
4107629.cif |
| 120076 | 2014-07-11 | Adding DOIs to range 4/10 structures. | 4107629.cif |
| 55331 | 2012-05-04 | cif/ Adding structures of 4107629 via cif-deposit CGI script. |
4107629.cif |
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Users of the data should acknowledge the original authors of the
structural data.