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Information card for entry 4341667
Preview
Coordinates | 4341667.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C34 H59 Cl2 Ir2 N P2 |
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Calculated formula | C34 H59 Cl2 Ir2 N P2 |
SMILES | [Ir]123([P](Cc4ccc(C[P]([Ir]567(Cl)[CH]8=[CH]5CC[CH]6=[CH]7CC8)(C(C)C)C(C)C)[nH]4)(C(C)C)C(C)C)(Cl)[CH]4=[CH]1CC[CH]3=[CH]2CC4 |
Title of publication | Ag(I) and Tl(I) Precursors as Transfer Agents of a Pyrrole-Based Pincer Ligand to Late Transition Metals. |
Authors of publication | Kessler, Julie A.; Iluc, Vlad M. |
Journal of publication | Inorganic chemistry |
Year of publication | 2014 |
Pages of publication | 141111134546005 |
a | 15.6504 ± 0.0017 Å |
b | 12.9926 ± 0.0014 Å |
c | 17.517 ± 0.0018 Å |
α | 90° |
β | 97.8616 ± 0.0018° |
γ | 90° |
Cell volume | 3528.4 ± 0.7 Å3 |
Cell temperature | 120 ± 2 K |
Ambient diffraction temperature | 120 ± 2 K |
Number of distinct elements | 6 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.0557 |
Residual factor for significantly intense reflections | 0.0338 |
Weighted residual factors for significantly intense reflections | 0.0556 |
Weighted residual factors for all reflections included in the refinement | 0.0588 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.023 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/4341667.html
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