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Information card for entry 4086714
Preview
Coordinates | 4086714.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | jonlm21 |
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Chemical name | (iPr-PONOP)W(CO)3 |
Formula | C20 H31 N O5 P2 W |
Calculated formula | C20 H31 N O5 P2 W |
SMILES | [W]12([P](Oc3[n]2c(O[P]1(C(C)C)C(C)C)ccc3)(C(C)C)C(C)C)(C#[O])(C#[O])C#[O] |
Title of publication | Synthesis, Characterization, and Reactivities of Molybdenum and Tungsten PONOP Pincer Complexes |
Authors of publication | Castro-Rodrigo, Ruth; Chakraborty, Sumit; Munjanja, Lloyd; Brennessel, William W.; Jones, William D. |
Journal of publication | Organometallics |
Year of publication | 2016 |
Journal volume | 35 |
Journal issue | 18 |
Pages of publication | 3124 |
a | 10.7399 ± 0.0019 Å |
b | 11.323 ± 0.002 Å |
c | 19.424 ± 0.004 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 2362.1 ± 0.8 Å3 |
Cell temperature | 100 ± 0.5 K |
Ambient diffraction temperature | 100 ± 0.5 K |
Number of distinct elements | 6 |
Space group number | 19 |
Hermann-Mauguin space group symbol | P 21 21 21 |
Hall space group symbol | P 2ac 2ab |
Residual factor for all reflections | 0.0187 |
Residual factor for significantly intense reflections | 0.0172 |
Weighted residual factors for significantly intense reflections | 0.036 |
Weighted residual factors for all reflections included in the refinement | 0.0363 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.079 |
Diffraction radiation wavelength | 0.71073 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/4086714.html
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Users of the data should acknowledge the original authors of the
structural data.