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Information card for entry 4087100
Preview
Coordinates | 4087100.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | PdCl(allyl)(CNArDipp2) |
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Formula | C36 H46 Cl N O0.5 Pd |
Calculated formula | C36 H46 Cl N O0.5 Pd |
Title of publication | Synthetic and Mechanistic Interrogation of Pd/Isocyanide-Catalyzed Cross-Coupling: π-Acidic Ligands Enable Self-Aggregating Monoligated Pd(0) Intermediates |
Authors of publication | Barnett, Brandon R.; Labios, Liezel A.; Stauber, Julia M.; Moore, Curtis E.; Rheingold, Arnold L.; Figueroa, Joshua S. |
Journal of publication | Organometallics |
Year of publication | 2017 |
Journal volume | 36 |
Journal issue | 4 |
Pages of publication | 944 |
a | 22.184 ± 0.006 Å |
b | 18.952 ± 0.005 Å |
c | 16.253 ± 0.005 Å |
α | 90° |
β | 105.03 ± 0.003° |
γ | 90° |
Cell volume | 6600 ± 3 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 K |
Number of distinct elements | 6 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0553 |
Residual factor for significantly intense reflections | 0.0378 |
Weighted residual factors for significantly intense reflections | 0.0834 |
Weighted residual factors for all reflections included in the refinement | 0.0972 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.046 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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The link is: https://www.crystallography.net/4087100.html
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