Information card for entry 4101743
Formula |
C25 H26 O4 |
Calculated formula |
C25 H26 O4 |
SMILES |
C1(C[C@@H]2C(c3cccc(c3C=C2C1)c1ccccc1)(C)C)(C(=O)OC)C(=O)OC |
Title of publication |
Gold(I)-Catalyzed Intramolecular [4+2] Cycloadditions of Arylalkynes or 1,3-Enynes with Alkenes: Scope and Mechanism |
Authors of publication |
Nieto-Oberhuber, Cristina; Pérez-Galán, Patricia; Herrero-Gómez, Elena; Lauterbach, Thorsten; Rodríguez, Cristina; López, Salomé; Bour, Christophe; Rosellón, Antonio; Cárdenas, Diego J.; Echavarren, Antonio M. |
Journal of publication |
Journal of the American Chemical Society |
Year of publication |
2008 |
Journal volume |
130 |
Journal issue |
1 |
Pages of publication |
269 - 279 |
a |
12.9697 ± 0.0014 Å |
b |
6.1221 ± 0.0007 Å |
c |
14.1396 ± 0.0015 Å |
α |
90° |
β |
112.992 ± 0.003° |
γ |
90° |
Cell volume |
1033.5 ± 0.2 Å3 |
Cell temperature |
100 ± 2 K |
Ambient diffraction temperature |
100 ± 2 K |
Number of distinct elements |
3 |
Space group number |
4 |
Hermann-Mauguin space group symbol |
P 1 21 1 |
Hall space group symbol |
P 2yb |
Residual factor for all reflections |
0.0422 |
Residual factor for significantly intense reflections |
0.0389 |
Weighted residual factors for significantly intense reflections |
0.1051 |
Weighted residual factors for all reflections included in the refinement |
0.1083 |
Goodness-of-fit parameter for all reflections included in the refinement |
1.059 |
Diffraction radiation wavelength |
0.71073 Å |
Diffraction radiation type |
MoKα |
Has coordinates |
Yes |
Has disorder |
No |
Has Fobs |
No |
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The link is:
https://www.crystallography.net/4101743.html