Information card for entry 7043785
Formula |
C23 H31 B N O2 P S |
Calculated formula |
C23 H31 B N O2 P S |
Title of publication |
The Phosphinoboration of Carbodiimides, Isocyanates, Isothiocyanates and CO2 |
Authors of publication |
Geier, Stephen; LaFortune, James; Zhu, Diya; Kosnik, Stephanie C.; Macdonald, Charles L. B.; Stephan, Douglas W.; Westcott, Steve |
Journal of publication |
Dalton Trans. |
Year of publication |
2017 |
a |
10.3603 ± 0.0012 Å |
b |
17.128 ± 0.0019 Å |
c |
26.966 ± 0.003 Å |
α |
92.761 ± 0.004° |
β |
93.308 ± 0.004° |
γ |
90.282 ± 0.004° |
Cell volume |
4771.5 ± 0.9 Å3 |
Cell temperature |
170 ± 2 K |
Ambient diffraction temperature |
170 ± 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 |
0.0688 |
Residual factor for significantly intense reflections |
0.0595 |
Weighted residual factors for significantly intense reflections |
0.1444 |
Weighted residual factors for all reflections included in the refinement |
0.1507 |
Goodness-of-fit parameter for all reflections included in the refinement |
1.099 |
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/7043785.html