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Information card for entry 4105196
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Coordinates | 4105196.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | AsP3FeCp*(dppe) |
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Formula | C60 H59 As B Cl0.75 Fe P5 |
Calculated formula | C60.75 H60.5 As B Cl1.5 Fe P5 |
Title of publication | Properties and Reactivity Patterns of AsP3: An Experimental and Computational Study of Group 15 Elemental Molecules |
Authors of publication | Brandi M. Cossairt; Christopher C. Cummins |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2009 |
Journal volume | 131 |
Pages of publication | 15501 - 15511 |
a | 22.7716 ± 0.0005 Å |
b | 22.7817 ± 0.0004 Å |
c | 24.361 ± 0.0008 Å |
α | 101.588 ± 0.001° |
β | 101.552 ± 0.001° |
γ | 113.098 ± 0.001° |
Cell volume | 10828 ± 0.5 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 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 | 0.0806 |
Residual factor for significantly intense reflections | 0.0668 |
Weighted residual factors for significantly intense reflections | 0.1771 |
Weighted residual factors for all reflections included in the refinement | 0.1871 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.052 |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
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/4105196.html
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