Information card for entry 7705462
| Formula |
C73 H82 B2 Cl2 Cu3 N12 O4 |
| Calculated formula |
C73 H82 B2 Cl2 Cu3 N12 O4 |
| Title of publication |
Aerobic intramolecular carbon-hydrogen bond oxidation promoted by Cu(I) complexes. |
| Authors of publication |
Álvarez, María; Molina, Francisco; Fructos, Manuel R.; Urbano, Juan; Álvarez, Eleuterio; Sodupe, Mariona; Lledós, Agustí; Pérez, Pedro J |
| Journal of publication |
Dalton transactions (Cambridge, England : 2003) |
| Year of publication |
2020 |
| Journal volume |
49 |
| Journal issue |
41 |
| Pages of publication |
14647 - 14655 |
| a |
12.7579 ± 0.0005 Å |
| b |
14.4057 ± 0.0006 Å |
| c |
21.7302 ± 0.0009 Å |
| α |
85.173 ± 0.001° |
| β |
74.863 ± 0.001° |
| γ |
67.326 ± 0.001° |
| Cell volume |
3556.6 ± 0.3 Å3 |
| Cell temperature |
193 ± 2 K |
| Ambient diffraction temperature |
193 ± 2 K |
| Number of distinct elements |
7 |
| Space group number |
2 |
| Hermann-Mauguin space group symbol |
P -1 |
| Hall space group symbol |
-P 1 |
| Residual factor for all reflections |
0.0693 |
| Residual factor for significantly intense reflections |
0.0469 |
| Weighted residual factors for significantly intense reflections |
0.1245 |
| Weighted residual factors for all reflections included in the refinement |
0.1359 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.061 |
| Diffraction radiation wavelength |
0.71073 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
No |
| Has Fobs |
No |
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https://www.crystallography.net/7705462.html
