Crystallography Open Database

Information card for entry 4081754

Preview

Coordinates	4081754.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	Sad234
Formula	C44.5 H58 B F15 Mg N2 Si4
Calculated formula	C44.5 H58 B F15 Mg N2 Si4
Title of publication	Nucleophilicity of Neutral versus Cationic Magnesium Silyl Compounds
Authors of publication	Yan, KaKing; Upton, Brianna M.; Zhu, Jing; Ellern, Arkady; Sadow, Aaron D.
Journal of publication	Organometallics
Year of publication	2013
Journal volume	32
Journal issue	22
Pages of publication	6834
a	42.495 ± 0.004 Å
b	13.638 ± 0.0014 Å
c	19.501 ± 0.002 Å
α	90°
β	109.258 ± 0.002°
γ	90°
Cell volume	10669.3 ± 1.8 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	7
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0877
Residual factor for significantly intense reflections	0.0608
Weighted residual factors for significantly intense reflections	0.1438
Weighted residual factors for all reflections included in the refinement	0.1602
Goodness-of-fit parameter for all reflections included in the refinement	1.112
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4081754.cif
91757	2013-12-13	cif/ Adding structures of 4081753, 4081754, 4081755, 4081756, 4081757 via cif-deposit CGI script.	4081754.cif