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Information card for entry 4347724
Preview
Coordinates | 4347724.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C58.8 H41.6 Cl1.6 Ir2 N8 |
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Calculated formula | C58.8 H41.6 Cl1.6 Ir2 N8 |
SMILES | c12c3n4c5c([n]3[Ir]36([n]2c2c(cccc2)n1[Ir]124([n]4c(cccc4)c4c2cccc4)[n]2c(cccc2)c2c1cccc2)([n]1c(cccc1)c1c6cccc1)[n]1c(cccc1)c1c3cccc1)cccc5.ClCCl |
Title of publication | Asymmetric Synthesis of Enantiomerically Pure Mono- and Binuclear Bis(cyclometalated) Iridium(III) Complexes. |
Authors of publication | Yao, Su-Yang; Ou, Yan-Ling; Ye, Bao-Hui |
Journal of publication | Inorganic chemistry |
Year of publication | 2016 |
Journal volume | 55 |
Journal issue | 12 |
Pages of publication | 6018 - 6026 |
a | 31.1358 ± 0.0006 Å |
b | 44.3487 ± 0.0008 Å |
c | 20.5543 ± 0.0004 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 28382 ± 0.9 Å3 |
Cell temperature | 151 ± 1 K |
Ambient diffraction temperature | 151 ± 1 K |
Number of distinct elements | 5 |
Space group number | 20 |
Hermann-Mauguin space group symbol | C 2 2 21 |
Hall space group symbol | C 2c 2 |
Residual factor for all reflections | 0.0622 |
Residual factor for significantly intense reflections | 0.0552 |
Weighted residual factors for significantly intense reflections | 0.145 |
Weighted residual factors for all reflections included in the refinement | 0.1524 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.071 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/4347724.html
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