Crystallography Open Database

Information card for entry 7122426

Preview

Coordinates	7122426.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C63 H45 F20 N9 S3 Th2
Calculated formula	C63 H45 F20 N9 S3 Th2
Title of publication	Organosoluble tetravalent actinide di- and trifluorides.
Authors of publication	Gotthelf, Garret; Stuber, Matthew A.; Kornienko, Anna Y.; Emge, Thomas J.; Brennan, John G.
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2018
Journal volume	54
Journal issue	85
Pages of publication	12018 - 12020
a	11.1776 ± 0.001 Å
b	12.1625 ± 0.0011 Å
c	25.368 ± 0.002 Å
α	81.4051 ± 0.0015°
β	86.7035 ± 0.0015°
γ	74.0481 ± 0.0015°
Cell volume	3278.2 ± 0.5 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0438
Residual factor for significantly intense reflections	0.036
Weighted residual factors for significantly intense reflections	0.0794
Weighted residual factors for all reflections included in the refinement	0.082
Goodness-of-fit parameter for all reflections included in the refinement	1.144
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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