Crystallography Open Database

Information card for entry 7046002

Preview

Coordinates	7046002.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H84 Ca N2 Si4
Calculated formula	C36 H84 Ca N2 Si4
Title of publication	Salt metathesis routes to homoleptic near-linear Mg(ii) and Ca(ii) bulky bis(silyl)amide complexes.
Authors of publication	Leng, Ji-Dong; Goodwin, Conrad A. P.; Vitorica-Yrezabal, Iñigo J; Mills, David P.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2018
Journal volume	47
Journal issue	36
Pages of publication	12526 - 12533
a	20.5592 ± 0.0005 Å
b	16.2479 ± 0.0007 Å
c	26.1021 ± 0.0008 Å
α	90°
β	90°
γ	90°
Cell volume	8719.2 ± 0.5 Å³
Cell temperature	150.03 ± 0.1 K
Ambient diffraction temperature	150.03 ± 0.1 K
Number of distinct elements	5
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.1177
Residual factor for significantly intense reflections	0.0589
Weighted residual factors for significantly intense reflections	0.1089
Weighted residual factors for all reflections included in the refinement	0.1383
Goodness-of-fit parameter for all reflections included in the refinement	1.012
Diffraction radiation probe	x-ray
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
229921 (current)	2019-11-17	cif/ Updating files of 7045998, 7045999, 7046000, 7046001, 7046002, 7046003 Original log message: Adding full bibliography for 7045998--7046003.cif.	7046002.cif
207286	2018-04-11	cif/ Adding structures of 7045998, 7045999, 7046000, 7046001, 7046002, 7046003 via cif-deposit CGI script.	7046002.cif