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Information card for entry 4081803
Preview
Coordinates | 4081803.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C51 H66 B2 N2 P2 |
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Calculated formula | C51 H66 B2 N2 P2 |
Title of publication | Reactivity of Phosphaboradibenzofulvene toward Hydrogen, Acetonitrile, Benzophenone, and 2,3-Dimethylbutadiene |
Authors of publication | Breunig, Jens Michael; Hübner, Alexander; Bolte, Michael; Wagner, Matthias; Lerner, Hans-Wolfram |
Journal of publication | Organometallics |
Year of publication | 2013 |
Journal volume | 32 |
Journal issue | 22 |
Pages of publication | 6792 |
a | 11.697 ± 0.002 Å |
b | 12.687 ± 0.003 Å |
c | 15.914 ± 0.003 Å |
α | 98.241 ± 0.017° |
β | 94.212 ± 0.017° |
γ | 97.434 ± 0.016° |
Cell volume | 2307.4 ± 0.8 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 2 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1921 |
Residual factor for significantly intense reflections | 0.0717 |
Weighted residual factors for significantly intense reflections | 0.1253 |
Weighted residual factors for all reflections included in the refinement | 0.1639 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.856 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4081803.html
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structural data.