Crystallography Open Database

Information card for entry 7718891

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Coordinates	7718891.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C174 H144 I24 N24 O6 Zn12
Calculated formula	C174 H144 I24 N24 O6 Zn12
Title of publication	<i>In situ</i> X-ray study of breathing-like effect in interlocked metal-organic nanocages.
Authors of publication	Martí-Rujas, Javier; Elli, Stefano; Famulari, Antonino
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2025
Journal volume	54
Journal issue	27
Pages of publication	10761 - 10768
a	38.6352 ± 0.0009 Å
b	38.6352 ± 0.0009 Å
c	15.8231 ± 0.0004 Å
α	90°
β	90°
γ	120°
Cell volume	20454.5 ± 0.8 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 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	0.1251
Residual factor for significantly intense reflections	0.1057
Weighted residual factors for significantly intense reflections	0.2809
Weighted residual factors for all reflections included in the refinement	0.2961
Goodness-of-fit parameter for all reflections included in the refinement	1.053
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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