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Information card for entry 4319996
Preview
Coordinates | 4319996.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C102 H190 Cl2 Mg4 O32 Si14 |
---|---|
Calculated formula | C94 H174 Cl2 Mg4 O30 Si14 |
SMILES | Cl[Mg]1([O]2[Mg]34[O]5[Si]6(C7CCCC7)O[Si@@]7(O[Si@]2(O[Si]2(C8CCCC8)O[Si@]([O]8[Mg]95[O]([Mg]8(Cl)[O]5CCCC5)[Si@@]5(O[Si@@]8(O[Si]([O]49)(O[Si@@]4(O[Si@]([O]13)(O[Si](C1CCCC1)(O5)O[Si](C1CCCC1)(O8)O4)C1CCCC1)C1CCCC1)C1CCCC1)C1CCCC1)C1CCCC1)(O[Si@@](O6)(C1CCCC1)O[Si](C1CCCC1)(O7)O2)C1CCCC1)C1CCCC1)C1CCCC1)[O]1CCCC1.C1CCCO1.C1CCCO1.C1CCCO1.C1CCCO1 |
Title of publication | Synthesis, Structural Characterization, and Transmetalation Reactions of a Tetranuclear Magnesium Silsesquioxane Complex |
Authors of publication | R. W. J. M. Hanssen; A. Meetsma; R. A. van Santen; H. C. L. Abbenhuis |
Journal of publication | Inorganic Chemistry |
Year of publication | 2001 |
Journal volume | 40 |
Pages of publication | 4049 - 4052 |
a | 15.744 ± 0.001 Å |
b | 26.526 ± 0.002 Å |
c | 16.917 ± 0.001 Å |
α | 90° |
β | 113.229 ± 0.002° |
γ | 90° |
Cell volume | 6492.3 ± 0.8 Å3 |
Cell temperature | 153 K |
Ambient diffraction temperature | 153 K |
Number of distinct elements | 6 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.1194 |
Residual factor for significantly intense reflections | 0.0628 |
Weighted residual factors for significantly intense reflections | 0.1502 |
Weighted residual factors for all reflections included in the refinement | 0.1732 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.96 |
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/4319996.html
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