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Information card for entry 7031813
Preview
Coordinates | 7031813.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C30 H33 Cl2 N O2 P2 Zn |
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Calculated formula | C30 H33 Cl2 N O2 P2 Zn |
SMILES | [Zn]1(Cl)(Cl)[O]=P(N(C(C)C)C(C)C)(c2c(P(=[O]1)(c1ccccc1)c1ccccc1)cccc2)c1ccccc1 |
Title of publication | Synthetic, structural, NMR and catalytic studies of phosphinic amide-phosphoryl chalcogenides (chalcogen = O, S, Se) as mixed-donor bidentate ligands in zinc chemistry. |
Authors of publication | Del Águila-Sánchez, Miguel A; Santos-Bastos, Neidemar M; Ramalho-Freitas, Maria C; García López, Jesús; Costa de Souza, Marcos; Camargos-Resende, Jackson A L; Casimiro, María; Alves-Romeiro, Gilberto; Iglesias, María José; López Ortiz, Fernando |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2014 |
Journal volume | 43 |
Journal issue | 37 |
Pages of publication | 14079 - 14091 |
a | 10.7651 ± 0.0004 Å |
b | 15.5932 ± 0.0005 Å |
c | 17.9816 ± 0.0006 Å |
α | 90° |
β | 91.666 ± 0.003° |
γ | 90° |
Cell volume | 3017.16 ± 0.18 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 7 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0743 |
Residual factor for significantly intense reflections | 0.0454 |
Weighted residual factors for significantly intense reflections | 0.1061 |
Weighted residual factors for all reflections included in the refinement | 0.1353 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.106 |
Diffraction radiation probe | x-ray |
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/7031813.html
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Users of the data should acknowledge the original authors of the
structural data.