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Information card for entry 7115029
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| Coordinates | 7115029.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | syn-[3.3](3,9)carbazolophane |
|---|---|
| Formula | C33 H27 N4 |
| Calculated formula | C33 H27 N4 |
| Title of publication | Synthesis and photophysical properties of [3.3](3,9)carbazolophanes |
| Authors of publication | Tani, Keita; Tohda, Yasuo; Takemura, Hiroyuki; Ohkita, Hideo; Ito, Shinzaburo; Yamamoto, Masahide |
| Journal of publication | Chemical Communications |
| Year of publication | 2001 |
| Journal issue | 19 |
| Pages of publication | 1914 |
| a | 14.035 ± 0.005 Å |
| b | 11.706 ± 0.004 Å |
| c | 15.041 ± 0.004 Å |
| α | 90° |
| β | 92.14 ± 0.03° |
| γ | 90° |
| Cell volume | 2469.4 ± 1.4 Å3 |
| Cell temperature | 293.2 K |
| Ambient diffraction temperature | 293.2 K |
| Number of distinct elements | 3 |
| 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 | 0.0369 |
| Residual factor for significantly intense reflections | 0.0369 |
| Weighted residual factors for significantly intense reflections | 0.0264 |
| Weighted residual factors for all reflections included in the refinement | 0.0264 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.36 |
| Diffraction radiation wavelength | 0.7107 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176453 (current) | 2016-02-16 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7. |
7115029.cif |
| 134283 | 2015-03-24 | cif/ (antanas@echidna.ibt.lt) Replaced '_reflns_observed_expression', '_atom_type_scat_imag' and '_atom_site_calc_flags' tags with their correct tag counterparts ('_reflns_threshold_expression', '_atom_type_scat_dispersion_imag', '_atom_site_calc_flag'). The following command was used on the CIFs containing the tags: xargs -n1 -I{} sh -c 'cif_correct_tags --r cod-tools/trunk/perl-scripts/inputs/replacement_tags.lst {} | cif_filter -h {} | sponge {}' A total of 124 files were changed. |
7115029.cif |
| 118491 | 2014-06-30 | cif/ Adding structures of 7115029, 7115030 via cif-deposit CGI script. |
7115029.cif |
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Users of the data should acknowledge the original authors of the
structural data.