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Information card for entry 2238663
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Coordinates | 2238663.cif |
---|---|
Original IUCr paper | HTML |
Common name | indenyliridiumbisethylene |
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Chemical name | Bis(η^2^-ethylene)(η^5^-indenyl)iridium(I) |
Formula | C13 H15 Ir |
Calculated formula | C13 H15 Ir |
SMILES | [Ir]123456([cH]7[cH]4[c]43[c]2([cH]17)cccc4)([CH2]=[CH2]5)[CH2]=[CH2]6 |
Title of publication | Bis(η^2^-ethylene)(η^5^-indenyl)iridium(I) |
Authors of publication | Merola, Joseph S. |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2013 |
Journal volume | 69 |
Journal issue | 10 |
Pages of publication | m547 |
a | 7.73182 ± 0.00011 Å |
b | 10.77708 ± 0.00013 Å |
c | 25.6818 ± 0.0005 Å |
α | 90° |
β | 98.4034 ± 0.0015° |
γ | 90° |
Cell volume | 2117 ± 0.06 Å3 |
Cell temperature | 100 ± 1 K |
Ambient diffraction temperature | 100 ± 1 K |
Number of distinct elements | 3 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0254 |
Residual factor for significantly intense reflections | 0.0243 |
Weighted residual factors for significantly intense reflections | 0.0544 |
Weighted residual factors for all reflections included in the refinement | 0.0548 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.46 |
Diffraction radiation wavelength | 0.7107 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/2238663.html
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