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Information card for entry 2015694
Preview
Coordinates | 2015694.cif |
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Structure factors | 2015694.hkl |
Original IUCr paper | HTML |
Chemical name | Tetra-μ-chloro-1:2κ^4^Cl;1:3κ^4^Cl-dimethyl-2κC,3κC- tetrakis(tetrahydrofuran)-1κ^2^O,2κO,3κO-chromium(II)dizinc(II) |
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Formula | C18 H38 Cl4 Cr O4 Zn2 |
Calculated formula | C18 H38 Cl4 Cr O4 Zn2 |
SMILES | C[Zn]([Cl][Cr]([O]1CCCC1)([O]1CCCC1)[Cl][Zn](C)([O]1CCCC1)Cl)([O]1CCCC1)Cl |
Title of publication | Tetra-μ-chloro-1:2κ^4^<i>Cl</i>;1:3κ^4^<i>Cl</i>-dimethyl-2κ<i>C</i>,3κ<i>C</i>-tetrakis(tetrahydrofuran)-1κ^2^<i>O</i>,2κ<i>O</i>,3κ<i>O</i>-chromium(II)dizinc(II) |
Authors of publication | Kreisel, Kevin A.; Yap, Glenn P. A.; Theopold, Klaus H. |
Journal of publication | Acta Crystallographica Section C |
Year of publication | 2006 |
Journal volume | 62 |
Journal issue | 12 |
Pages of publication | m569 - m570 |
a | 7.853 ± 0.0014 Å |
b | 8.8695 ± 0.0016 Å |
c | 10.7901 ± 0.0019 Å |
α | 68.759 ± 0.002° |
β | 71.741 ± 0.002° |
γ | 77.434 ± 0.002° |
Cell volume | 660.6 ± 0.2 Å3 |
Cell temperature | 120 ± 2 K |
Ambient diffraction temperature | 120 ± 2 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0239 |
Residual factor for significantly intense reflections | 0.0226 |
Weighted residual factors for significantly intense reflections | 0.0581 |
Weighted residual factors for all reflections included in the refinement | 0.0592 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.03 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | Yes |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/2015694.html
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