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Information card for entry 7001269
Preview
Coordinates | 7001269.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C37 H32 F3 Ir N4 O3 S |
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Calculated formula | C37 H32 F3 Ir N4 O3 S |
SMILES | [Ir]123([n]4ccc(cc4c4[n]1ccc(c4)C)C)([n]1ccc(cc1c1[n]2ccc(c1)C)C)c1ccccc1c1ccccc31.C(F)(F)(F)S(=O)(=O)[O-] |
Title of publication | New heteroleptic iridium complexes having one biphenyl-2,2′-diyl and two bipyridyl based ligands |
Authors of publication | Lee, Kyu Reon; Eum, Min-Sik; Chin, Chong Shik; Lee, Seung Chan; Kim, In June; Kim, Young Sik; Kim, Youngmee; Kim, Sung-Jin; Hur, Nam Hwi |
Journal of publication | Dalton Transactions |
Year of publication | 2009 |
Journal issue | 19 |
Pages of publication | 3650 - 3652 |
a | 34.693 ± 0.002 Å |
b | 11.2292 ± 0.0006 Å |
c | 18.9912 ± 0.0011 Å |
α | 90° |
β | 107.122 ± 0.001° |
γ | 90° |
Cell volume | 7070.6 ± 0.7 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 7 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.0539 |
Residual factor for significantly intense reflections | 0.0401 |
Weighted residual factors for significantly intense reflections | 0.123 |
Weighted residual factors for all reflections included in the refinement | 0.1293 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.032 |
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/7001269.html
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