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Information card for entry 1567596
Preview
Coordinates | 1567596.cif |
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Original paper (by DOI) | HTML |
Chemical name | Br(CH3CH2)HSnNi3(dppm)3H |
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Formula | C81 H80 Br Ni3 O P6 Sn |
Calculated formula | C81 H80 Br Ni3 O P6 Sn |
Title of publication | Synthesis, Structure and Reactivity of µ3-SnH Capped Trinuclear Nickel Cluster |
Authors of publication | Torquato, Nicole A.; Mrse, Anthony A.; Gembicky, Milan; Chan, Thomas; Brunner, Felix M.; Kubiak, Clifford P.; Bertrand, Quentin C.; Palasz, Joseph M. |
Journal of publication | Chemical Science |
Year of publication | 2022 |
a | 12.692 ± 0.0006 Å |
b | 13.093 ± 0.0008 Å |
c | 24.4579 ± 0.0014 Å |
α | 90.583 ± 0.002° |
β | 102.885 ± 0.002° |
γ | 112.374 ± 0.002° |
Cell volume | 3643.3 ± 0.4 Å3 |
Cell temperature | 100 K |
Ambient diffraction temperature | 100 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 | 0.0852 |
Residual factor for significantly intense reflections | 0.0464 |
Weighted residual factors for significantly intense reflections | 0.0921 |
Weighted residual factors for all reflections included in the refinement | 0.1086 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.017 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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