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Information card for entry 4122332
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Coordinates | 4122332.cif |
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Original paper (by DOI) | HTML |
Chemical name | [{In{B(NArCH)2}}2{C6H10}]. 0.25(C6H14) |
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Formula | C223 H315 B8 In4 N16 |
Calculated formula | C223 H315 B8 In4 N16 |
Title of publication | Oxidative Bond Formation and Reductive Bond Cleavage at Main Group Metal Centers: Reactivity of Five-Valence-Electron MX2 Radicals. |
Authors of publication | Protchenko, Andrey V.; Dange, Deepak; Blake, Matthew P.; Schwarz, Andrew D.; Jones, Cameron; Mountford, Philip; Aldridge, Simon |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2014 |
Journal volume | 136 |
Journal issue | 31 |
Pages of publication | 10902 - 10905 |
a | 39.8417 ± 0.0003 Å |
b | 13.1343 ± 0.0001 Å |
c | 45.0886 ± 0.0004 Å |
α | 90° |
β | 103.456 ± 0.0008° |
γ | 90° |
Cell volume | 22946.9 ± 0.3 Å3 |
Cell temperature | 150 K |
Ambient diffraction temperature | 150 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.0444 |
Residual factor for significantly intense reflections | 0.0391 |
Weighted residual factors for all reflections | 0.0257 |
Weighted residual factors for significantly intense reflections | 0.0244 |
Weighted residual factors for all reflections included in the refinement | 0.024 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.0376 |
Diffraction radiation wavelength | 1.5418 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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