Crystallography Open Database

Information card for entry 7241351

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Coordinates	7241351.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C270 H270 Co24 N18 O84 S30
Calculated formula	C270 H270 Co24 N18 O84 S30
Title of publication	Two Sulfur and Nitrogen-rich Cobalt-thiacalix[4]arene Compounds for Selective Mercury Removal from Aqueous Solution
Authors of publication	Li, Kaiyue; Liao, Wuping
Journal of publication	CrystEngComm
Year of publication	2020
a	36.5063 ± 0.0013 Å
b	36.5063 ± 0.0013 Å
c	28.7488 ± 0.0011 Å
α	90°
β	90°
γ	120°
Cell volume	33181 ± 2 Å³
Cell temperature	190 ± 2 K
Ambient diffraction temperature	190 ± 2 K
Number of distinct elements	6
Space group number	148
Hermann-Mauguin space group symbol	R -3 :H
Hall space group symbol	-R 3
Residual factor for all reflections	0.1528
Residual factor for significantly intense reflections	0.1198
Weighted residual factors for significantly intense reflections	0.3145
Weighted residual factors for all reflections included in the refinement	0.3424
Goodness-of-fit parameter for all reflections included in the refinement	1.292
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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