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Information card for entry 4069549
Preview
Coordinates | 4069549.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C34 H27 Cl4 P Pd |
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Calculated formula | C34 H27 Cl4 P Pd |
SMILES | [Pd](=c1c2ccccc2ccc2ccccc12)(Cl)(Cl)[P](c1ccccc1)(c1ccccc1)c1ccccc1.ClCCl |
Title of publication | Complexation of (5H)-Dibenzo[a,d]cyclohepten-5-ylidene to Palladium(II) via the Diazo Route and Evidence of C−H···Pd Interactions |
Authors of publication | Taubmann, Christian; Öfele, Karl; Herdtweck, Eberhardt; Herrmann, Wolfgang A. |
Journal of publication | Organometallics |
Year of publication | 2009 |
Journal volume | 28 |
Journal issue | 15 |
Pages of publication | 4254 |
a | 20.2199 ± 0.0004 Å |
b | 17.5722 ± 0.0004 Å |
c | 16.9145 ± 0.0004 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 6009.9 ± 0.2 Å3 |
Cell temperature | 173 ± 1 K |
Ambient diffraction temperature | 173 ± 1 K |
Number of distinct elements | 5 |
Space group number | 29 |
Hermann-Mauguin space group symbol | P c a 21 |
Hall space group symbol | P 2c -2ac |
Residual factor for all reflections | 0.0434 |
Residual factor for significantly intense reflections | 0.0369 |
Weighted residual factors for significantly intense reflections | 0.091 |
Weighted residual factors for all reflections included in the refinement | 0.0949 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.029 |
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/4069549.html
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