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Information card for entry 4063677
Preview
Coordinates | 4063677.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C98 H112 Cl2 N2 O11 P4 Pd2 |
---|---|
Calculated formula | C98 H112 Cl2 N2 O11 P4 Pd2 |
SMILES | [Pd]12([P](CCCCC[P]([Pd]([P](CCCCC[P]1(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)(Cl)c1cc(c2cc1/C=N/c1ccc2OCCOCCOCCOCCOc2c1)/C=N/c1ccc2OCCOCCOCCOCCOc2c1)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)Cl.O(CC)CC |
Title of publication | Dimetalated Crown Ether Schiff Base Palladacycles. Influence of the Carbon Chain Length on the Coordination Mode of Bidentate Phosphines. Crystal and Molecular Structure of the Novel Complex [Pd2{1,4-[C(H)═N{9,10-(C8H16O5)C6H3}]2C6H2-C2,C5}(Cl)2{μ-Ph2P(CH2)5PPh2}2] |
Authors of publication | Fernández, Alberto; López-Torres, Margarita; Castro-Juiz, Samuel; Merino, Manuel; Vázquez-García, Digna; Vila, José M.; Fernández, Jesús J. |
Journal of publication | Organometallics |
Year of publication | 2011 |
Journal volume | 30 |
Journal issue | 3 |
Pages of publication | 386 |
a | 13.0434 ± 0.0002 Å |
b | 15.7309 ± 0.0002 Å |
c | 23.6952 ± 0.0001 Å |
α | 88.143 ± 0.001° |
β | 77.156 ± 0.001° |
γ | 76.207 ± 0.001° |
Cell volume | 4602.46 ± 0.1 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 7 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0743 |
Residual factor for significantly intense reflections | 0.0438 |
Weighted residual factors for significantly intense reflections | 0.0897 |
Weighted residual factors for all reflections included in the refinement | 0.105 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.063 |
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/4063677.html
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