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Information card for entry 4084212
Preview
Coordinates | 4084212.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C21 H12 Cl N2 O3 Re |
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Calculated formula | C21 H12 Cl N2 O3 Re |
SMILES | [Re]1(Cl)(C#[O])(C#[O])(C#[O])[n]2cc(C#Cc3ccccc3)ccc2c2[n]1cccc2 |
Title of publication | Coordinating Tectons: Bimetallic Complexes from Bipyridyl Terminated Group 8 Alkynyl Complexes |
Authors of publication | Koutsantonis, George A.; Low, Paul J.; Mackenzie, Campbell F. R.; Skelton, Brian W.; Yufit, Dmitry S. |
Journal of publication | Organometallics |
Year of publication | 2014 |
Journal volume | 33 |
Journal issue | 18 |
Pages of publication | 4911 |
a | 6.5734 ± 0.0002 Å |
b | 19.1588 ± 0.0007 Å |
c | 29.6134 ± 0.0015 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 3729.5 ± 0.3 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 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 | 0.0806 |
Residual factor for significantly intense reflections | 0.0604 |
Weighted residual factors for significantly intense reflections | 0.1324 |
Weighted residual factors for all reflections included in the refinement | 0.1487 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.988 |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
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/4084212.html
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