Information card for entry 4071386
Formula |
C10 H17 O3 P |
Calculated formula |
C10 H17 O3 P |
SMILES |
P1[C@]2(O[C@@]3(O[C@@](O[C@]1(C3)C)(C2)C)C)C.P1[C@@]2(O[C@]3(O[C@](O[C@@]1(C3)C)(C2)C)C)C |
Title of publication |
General Routes to Alkyl Phosphatrioxaadamantane Ligands |
Authors of publication |
Downing, Joanne H.; Floure, Joëlle; Heslop, Katie; Haddow, Mairi F.; Hopewell, Jonathan; Lusi, Matteo; Phetmung, Hirahataya; Orpen, A. Guy; Pringle, Paul G.; Pugh, Robert I.; Zambrano-Williams, Damaris |
Journal of publication |
Organometallics |
Year of publication |
2008 |
Journal volume |
27 |
Journal issue |
13 |
Pages of publication |
3216 |
a |
8.176 ± 0.002 Å |
b |
8.0969 ± 0.0013 Å |
c |
16.669 ± 0.003 Å |
α |
90° |
β |
94.144 ± 0.013° |
γ |
90° |
Cell volume |
1100.6 ± 0.4 Å3 |
Cell temperature |
173 ± 2 K |
Ambient diffraction temperature |
173 ± 2 K |
Number of distinct elements |
4 |
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 |
0.0455 |
Residual factor for significantly intense reflections |
0.0331 |
Weighted residual factors for significantly intense reflections |
0.0854 |
Weighted residual factors for all reflections included in the refinement |
0.0903 |
Goodness-of-fit parameter for all reflections included in the refinement |
1.028 |
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/4071386.html