Crystallography Open Database

Information card for entry 7229234

Preview

Coordinates	7229234.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C45 H55 Mg N O2 Si
Calculated formula	C45 H55 Mg N O2 Si
SMILES	[Si](N([Mg](C)([O]1CCCC1)[O]1CCCC1)c1c(cc(C)cc1C(c1ccccc1)c1ccccc1)C(c1ccccc1)c1ccccc1)(C)(C)C
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	14.9209 ± 0.0009 Å
b	18.7056 ± 0.0012 Å
c	14.3767 ± 0.0009 Å
α	90°
β	93.052 ± 0.002°
γ	90°
Cell volume	4006.9 ± 0.4 Å³
Cell temperature	135 ± 2 K
Ambient diffraction temperature	135 ± 2 K
Number of distinct elements	6
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	0.1195
Residual factor for significantly intense reflections	0.0736
Weighted residual factors for significantly intense reflections	0.1669
Weighted residual factors for all reflections included in the refinement	0.1957
Goodness-of-fit parameter for all reflections included in the refinement	1.006
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.	7229234.cif