Crystallography Open Database

Information card for entry 1563142

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Coordinates	1563142.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48 H100 K N7 O6 Si6 U
Calculated formula	C48 H100 K N7 O6 Si6 U
Title of publication	Single metal four-electron reduction by U(ii) and masked "U(ii)" compounds.
Authors of publication	Modder, Dieuwertje K.; Palumbo, Chad T.; Douair, Iskander; Scopelliti, Rosario; Maron, Laurent; Mazzanti, Marinella
Journal of publication	Chemical science
Year of publication	2021
Journal volume	12
Journal issue	17
Pages of publication	6153 - 6158
a	22.6297 ± 0.0005 Å
b	23.9733 ± 0.0005 Å
c	23.9063 ± 0.0005 Å
α	90°
β	92.9909 ± 0.0018°
γ	90°
Cell volume	12951.7 ± 0.5 Å³
Cell temperature	139.9 ± 0.6 K
Ambient diffraction temperature	139.9 ± 0.6 K
Number of distinct elements	7
Space group number	15
Hermann-Mauguin space group symbol	I 1 2/a 1
Hall space group symbol	-I 2ya
Residual factor for all reflections	0.0934
Residual factor for significantly intense reflections	0.0502
Weighted residual factors for significantly intense reflections	0.1186
Weighted residual factors for all reflections included in the refinement	0.1328
Goodness-of-fit parameter for all reflections included in the refinement	0.841
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
265778 (current)	2021-06-04	cif/ Adding structures of 1563141, 1563142, 1563143 via cif-deposit CGI script.	1563142.cif