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Information card for entry 7038502
Preview
Coordinates | 7038502.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C33 H74 Al Cl8 Mg3 N7 Si |
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Calculated formula | C33 H74 Al Cl8 Mg3 N7 Si |
SMILES | [Al](Cl)(Cl)(Cl)N([Si](C)(C)C)c1c(cccc1C(C)C)C(C)C.[Mg]1234([Cl][Mg]567([Cl][Mg]8([Cl]27)([Cl]35)([Cl]4)[N](C)(CC[N]8(C)C)C)[N](CC[N]6(C)C)(C)C)[N](C)(CC[N]1(C)C)C |
Title of publication | Exposing elusive cationic magnesium-chloro aggregates in aluminate complexes through donor control. |
Authors of publication | Brouillet, Etienne V.; Kennedy, Alan R.; Koszinowski, Konrad; McLellan, Ross; Mulvey, Robert E.; Robertson, Stuart D. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2016 |
Journal volume | 45 |
Journal issue | 13 |
Pages of publication | 5590 - 5597 |
a | 19.692 ± 0.002 Å |
b | 16.2309 ± 0.0012 Å |
c | 16.9709 ± 0.0015 Å |
α | 90° |
β | 107.61 ± 0.011° |
γ | 90° |
Cell volume | 5170 ± 0.9 Å3 |
Cell temperature | 123 ± 2 K |
Ambient diffraction temperature | 123 ± 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 | 0.1082 |
Residual factor for significantly intense reflections | 0.0508 |
Weighted residual factors for significantly intense reflections | 0.0886 |
Weighted residual factors for all reflections included in the refinement | 0.0992 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.798 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/7038502.html
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