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Information card for entry 4088132
Preview
Coordinates | 4088132.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C19 H13 I2 N3 O2 Ru |
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Calculated formula | C19 H13 I2 N3 O2 Ru |
SMILES | [Ru]1(I)(I)(c2n3c([n+](c2)C)c(cc2c3[n]1ccc2)c1ccccc1)(C#[O])C#[O] |
Title of publication | Oxidative Route to Abnormal NHC Compounds from Singly Bonded [M‒M] (M = Ru, Rh, Pd) Precursors |
Authors of publication | Saha, Sayantani; Daw, Prosenjit; Bera, Jitendra K. |
Journal of publication | Organometallics |
Year of publication | 2015 |
Journal volume | 34 |
Journal issue | 23 |
Pages of publication | 5509 |
a | 9.0217 ± 0.0019 Å |
b | 11.036 ± 0.002 Å |
c | 20.128 ± 0.004 Å |
α | 90° |
β | 102.372 ± 0.003° |
γ | 90° |
Cell volume | 1957.5 ± 0.7 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 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 | 0.048 |
Residual factor for significantly intense reflections | 0.0396 |
Weighted residual factors for significantly intense reflections | 0.1035 |
Weighted residual factors for all reflections included in the refinement | 0.1098 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.053 |
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/4088132.html
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