Crystallography Open Database

Information card for entry 7247479

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Coordinates	7247479.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H23 N5 O4
Calculated formula	C20 H23 N5 O4
Title of publication	Design and synthesis of covalently tethered “isoG-star” as a recyclable host for selective cesium separation
Authors of publication	Liu, Mengjia; He, Ying; Wojtas, Lukasz; Shi, Xiaodong
Journal of publication	Green Chemistry
Year of publication	2023
Journal volume	25
Journal issue	21
Pages of publication	8494 - 8499
a	11.4448 ± 0.0003 Å
b	8.3202 ± 0.0002 Å
c	20.9237 ± 0.0006 Å
α	90°
β	104.738 ± 0.001°
γ	90°
Cell volume	1926.87 ± 0.09 Å³
Cell temperature	134.68 K
Ambient diffraction temperature	134.68 K
Number of distinct elements	4
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	0.0575
Residual factor for significantly intense reflections	0.0491
Weighted residual factors for significantly intense reflections	0.1279
Weighted residual factors for all reflections included in the refinement	0.1358
Goodness-of-fit parameter for all reflections included in the refinement	1.046
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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