Crystallography Open Database

Information card for entry 2312106

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Structure parameters

Chemical name	Di-μ~3~-chlorido-tetra-μ~2~-chlorido-tetrakis(diethyl ether-κ<i>O</i>)bis(1,1-dimethylethyl)tetramagnesium
Formula	C24 H58 Cl6 Mg4 O4
Calculated formula	C24 H58 Cl6 Mg4 O4
SMILES	[Mg]123([Cl][Mg]4([Cl][Mg]5([Cl][Mg]([Cl]1)([Cl]35)C(C)(C)C)([Cl]24)([O](CC)CC)[O](CC)CC)C(C)(C)C)([O](CC)CC)[O](CC)CC
Title of publication	Crystal structure of [<i>t</i>BuMgCl]<sub>2</sub>[MgCl<sub>2</sub>(Et<sub>2</sub>O)<sub>2</sub>]<sub>2</sub>.
Authors of publication	Metzler, Maurice; Bolte, Michael; Wagner, Matthias; Lerner, Hans-Wolfram
Journal of publication	Acta crystallographica. Section E, Crystallographic communications
Year of publication	2023
Journal volume	79
Journal issue	Pt 4
Pages of publication	341 - 344
a	11.5663 ± 0.0005 Å
b	15.4045 ± 0.0008 Å
c	22.8256 ± 0.0011 Å
α	90°
β	99.209 ± 0.004°
γ	90°
Cell volume	4014.5 ± 0.3 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	5
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	0.0486
Residual factor for significantly intense reflections	0.0302
Weighted residual factors for significantly intense reflections	0.0621
Weighted residual factors for all reflections included in the refinement	0.0662
Goodness-of-fit parameter for all reflections included in the refinement	0.928
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

Version history

Revision	Date	Message	Files
283569 (current)	2023-05-06	cif/ hkl/ Adding structures of 2312106 via cif-deposit CGI script.	2312106.cif 2312106.hkl