Crystallography Open Database

Information card for entry 7229235

Preview

Coordinates	7229235.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C58 H57 Mg N O Si
Calculated formula	C58 H57 Mg N O Si
SMILES	[Si](N(c1c(cc(cc1C(c1ccccc1)c1ccccc1)C(C)C)C(c1ccccc1)c1ccccc1)[Mg](C)[O]1CCCC1)(c1ccccc1)(c1ccccc1)c1ccccc1
Title of publication	Sterically bulky amido magnesium methyl complexes: syntheses, structures and catalysis
Authors of publication	Ma, Mengtao; Li, Jia; Shen, Xingchao; Yu, Zhijuan; Yao, Weiwei; Pullarkat, Sumod A.
Journal of publication	RSC Adv.
Year of publication	2017
Journal volume	7
Journal issue	72
Pages of publication	45401
a	11.0079 ± 0.0006 Å
b	11.3921 ± 0.0005 Å
c	20.2197 ± 0.001 Å
α	75.751 ± 0.001°
β	87.559 ± 0.002°
γ	71.681 ± 0.001°
Cell volume	2331.4 ± 0.2 Å³
Cell temperature	135 ± 2 K
Ambient diffraction temperature	135 ± 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	0.0628
Residual factor for significantly intense reflections	0.0503
Weighted residual factors for significantly intense reflections	0.1525
Weighted residual factors for all reflections included in the refinement	0.1634
Goodness-of-fit parameter for all reflections included in the refinement	1.197
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
201254 (current)	2017-09-25	cif/ Adding structures of 7229234, 7229235, 7229236, 7229237 via cif-deposit CGI script.	7229235.cif