Crystallography Open Database

Information card for entry 7131662

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Coordinates	7131662.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C50 H64 N4 O14
Calculated formula	C50 H64 N4 O14
Title of publication	Selective adsorption of trace morpholine impurities over <i>N</i>-ethyl morpholine by tetralactam solids.
Authors of publication	Li, Shi-Yao; Yao, Huan; Hu, Hao; Chen, Wen-Jie; Yang, Liu-Pan; Wang, Li-Li
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2023
Journal volume	59
Journal issue	47
Pages of publication	7204 - 7207
a	9.483 ± 0.002 Å
b	10.987 ± 0.003 Å
c	12.79 ± 0.003 Å
α	68.707 ± 0.007°
β	82.307 ± 0.007°
γ	73.621 ± 0.007°
Cell volume	1190.5 ± 0.5 Å³
Cell temperature	214.56 K
Ambient diffraction temperature	214.56 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0895
Residual factor for significantly intense reflections	0.0566
Weighted residual factors for significantly intense reflections	0.1328
Weighted residual factors for all reflections included in the refinement	0.1482
Goodness-of-fit parameter for all reflections included in the refinement	1.068
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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