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Information card for entry 4089331
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Coordinates | 4089331.cif |
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Original paper (by DOI) | HTML |
Formula | C48 H45 I O3 P2 Pd |
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Calculated formula | C48 H45 I O3 P2 Pd |
Title of publication | Palladacycles with a Metal-Bonded sp3-Hybridized Carbon as Intermediates in the Synthesis of 2,2,3,4-Tetrasubstituted 2H-1-Benzopyrans and 1,2-Dihydroquinolines. Effects of Auxiliary Ligands and Substitution at a Palladium-Bonded Tertiary Carbon |
Authors of publication | Lu, Genliang; Portscheller, Janelle L.; Malinakova, Helena C. |
Journal of publication | Organometallics |
Year of publication | 2005 |
Journal volume | 24 |
Journal issue | 5 |
Pages of publication | 945 |
a | 9.734 ± 0.002 Å |
b | 14.126 ± 0.003 Å |
c | 15.694 ± 0.004 Å |
α | 75.415 ± 0.003° |
β | 88.903 ± 0.003° |
γ | 77.105 ± 0.003° |
Cell volume | 2034.2 ± 0.8 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0359 |
Residual factor for significantly intense reflections | 0.0307 |
Weighted residual factors for significantly intense reflections | 0.0795 |
Weighted residual factors for all reflections included in the refinement | 0.0826 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.03 |
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/4089331.html
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