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Information card for entry 4080337
Preview
Coordinates | 4080337.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C62 H71 F12 Ir N O5 P3 Sb2 |
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Calculated formula | C62 H57 F12 Ir N O5 P3 Sb2 |
Title of publication | Chiral Octahedral Phosphano‒Oxazoline Iridium(III) Complexes as Catalysts in Asymmetric Cycloaddition Reactions |
Authors of publication | Carmona, Daniel; Ferrer, Joaquina; Garc\?ía, Néstor; Ram\?írez, Paola; Lahoz, Fernando J.; Garc\?ía-Orduña, Pilar; Oro, Luis A. |
Journal of publication | Organometallics |
Year of publication | 2013 |
Journal volume | 32 |
Journal issue | 6 |
Pages of publication | 1609 |
a | 11.6736 ± 0.0008 Å |
b | 23.6185 ± 0.0017 Å |
c | 11.8942 ± 0.0008 Å |
α | 90° |
β | 94.527 ± 0.001° |
γ | 90° |
Cell volume | 3269.2 ± 0.4 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 8 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.0779 |
Residual factor for significantly intense reflections | 0.0605 |
Weighted residual factors for significantly intense reflections | 0.1093 |
Weighted residual factors for all reflections included in the refinement | 0.117 |
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/4080337.html
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