Crystallography Open Database

Information card for entry 1571047

Preview

Coordinates	1571047.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C56 H118 I N O8 Si2 Sr
Calculated formula	C56 H118 I N O8 Si2 Sr
Title of publication	s-Block metal complexes of superbulky (<sup><i>t</i></sup>Bu<sub>3</sub>Si)<sub>2</sub>N<sup>-</sup>: a new weakly coordinating anion?
Authors of publication	Knüpfer, Christian; Klerner, Lukas; Mai, Jonathan; Langer, Jens; Harder, Sjoerd
Journal of publication	Chemical science
Year of publication	2024
Journal volume	15
Journal issue	12
Pages of publication	4386 - 4395
a	20.1783 ± 0.0002 Å
b	12.98186 ± 0.00013 Å
c	25.395 ± 0.0003 Å
α	90°
β	106.455 ± 0.0012°
γ	90°
Cell volume	6379.8 ± 0.12 Å³
Cell temperature	100 ± 0.6 K
Ambient diffraction temperature	100 ± 0.6 K
Number of distinct elements	7
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0289
Residual factor for significantly intense reflections	0.0268
Weighted residual factors for significantly intense reflections	0.067
Weighted residual factors for all reflections included in the refinement	0.0687
Goodness-of-fit parameter for all reflections included in the refinement	1.057
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
290874 (current)	2024-04-05	cif/ Updating files of 1571041, 1571042, 1571043, 1571044, 1571045, 1571046, 1571047, 1571048, 1571049, 1571050, 1571051, 1571052 Original log message: Adding full bibliography for 1571041--1571052.cif.	1571047.cif
289885	2024-02-21	cif/ Adding structures of 1571041, 1571042, 1571043, 1571044, 1571045, 1571046, 1571047, 1571048, 1571049, 1571050, 1571051, 1571052 via cif-deposit CGI script.	1571047.cif