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Information card for entry 7007700
Preview
Coordinates | 7007700.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C60 H68 Cl4 F12 N2 O6 P6 Pd Sb2 |
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Calculated formula | C60 H68 Cl4 F12 N2 O6 P6 Pd Sb2 |
SMILES | C1[P](c2ccccc2)(c2ccccc2)[Pd]2([N](=P1(c1ccccc1)c1ccccc1)P(=O)(OCC)OCC)[O]=P(N=P(C[P]2(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)(OCC)OCC.C(Cl)Cl.C(Cl)Cl.F[Sb](F)(F)(F)(F)[F-].F[Sb](F)(F)([F-])(F)F |
Title of publication | Synthesis and reactivity studies of palladium(II) complexes containing the N-phosphorylated iminophosphorane-phosphine ligands Ph2PCH2P{=NP(=O)(OR)2}Ph2 (R=Et, Ph): application to the catalytic synthesis of 2,3-dimethylfuran. |
Authors of publication | Cadierno, Victorio; Díez, Josefina; García-Alvarez, Joaquín; Gimeno, José; Nebra, Noel; Rubio-García, Javier |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2006 |
Journal issue | 47 |
Pages of publication | 5593 - 5604 |
a | 12.5698 ± 0.0004 Å |
b | 13.6979 ± 0.0004 Å |
c | 21.398 ± 0.0007 Å |
α | 82.941 ± 0.002° |
β | 86.073 ± 0.002° |
γ | 75.89 ± 0.002° |
Cell volume | 3543.22 ± 0.19 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 9 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0805 |
Residual factor for significantly intense reflections | 0.0631 |
Weighted residual factors for significantly intense reflections | 0.1667 |
Weighted residual factors for all reflections included in the refinement | 0.18 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.047 |
Diffraction radiation wavelength | 1.5418 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/7007700.html
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