Information card for entry 7051114
| Chemical name |
1,8-Dibenzoyloxy-bicyclo[6.6.4]octadeca-4,11-diene-2,6,9,13-tetrayne |
| Formula |
C32 H26 O2 |
| Calculated formula |
C32 H26 O2 |
| Title of publication |
Synthesis and structure of bicyclic enediynes via twofold carbenoid ring closure |
| Authors of publication |
König, Burkhard; Pitsch, Wolfgang; Dix, Ina; Jones, Peter G. |
| Journal of publication |
New Journal of Chemistry |
| Year of publication |
2001 |
| Journal volume |
25 |
| Journal issue |
7 |
| Pages of publication |
912 - 916 |
| a |
9.108 ± 0.004 Å |
| b |
11.199 ± 0.003 Å |
| c |
25.19 ± 0.006 Å |
| α |
96.03 ± 0.03° |
| β |
97.718 ± 0.018° |
| γ |
109.5 ± 0.03° |
| Cell volume |
2369 ± 1.4 Å3 |
| Cell temperature |
143 ± 2 K |
| Ambient diffraction temperature |
143 ± 2 K |
| Number of distinct elements |
3 |
| Space group number |
2 |
| Hermann-Mauguin space group symbol |
P -1 |
| Hall space group symbol |
-P 1 |
| Residual factor for all reflections |
0.1476 |
| Residual factor for significantly intense reflections |
0.0612 |
| Weighted residual factors for all reflections |
0.1446 |
| Weighted residual factors for significantly intense reflections |
0.1111 |
| Goodness-of-fit parameter for all reflections |
1.018 |
| Goodness-of-fit parameter for significantly intense reflections |
1.137 |
| Diffraction radiation wavelength |
0.71073 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
Yes |
| Has Fobs |
No |
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https://www.crystallography.net/7051114.html
