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Information card for entry 7701728
Preview
Coordinates | 7701728.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C128 H100 Ir2 N8 O4 P2 |
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Calculated formula | C128 H100 Ir2 N8 O4 P2 |
Title of publication | Iridium porphyrin complexes with μ-nitrido, hydroxo, hydrosulfido and alkynyl ligands. |
Authors of publication | So, Shiu-Chun; Cheung, Wai-Man; Chiu, Wai-Hang; de Vere-Tucker, Matthew; Sung, Herman H.-Y.; Williams, Ian D.; Leung, Wa-Hung |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2019 |
Journal volume | 48 |
Journal issue | 23 |
Pages of publication | 8340 - 8349 |
a | 26.2427 ± 0.0002 Å |
b | 10.41332 ± 0.00013 Å |
c | 35.1224 ± 0.0003 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 9598.03 ± 0.16 Å3 |
Cell temperature | 100.1 ± 0.1 K |
Ambient diffraction temperature | 100.1 ± 0.1 K |
Number of distinct elements | 6 |
Space group number | 29 |
Hermann-Mauguin space group symbol | P c a 21 |
Hall space group symbol | P 2c -2ac |
Residual factor for all reflections | 0.0279 |
Residual factor for significantly intense reflections | 0.0264 |
Weighted residual factors for significantly intense reflections | 0.0641 |
Weighted residual factors for all reflections included in the refinement | 0.0651 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.046 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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