Crystallography Open Database

Information card for entry 4123358

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Coordinates	4123358.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C92 H82 N12 O32
Calculated formula	C92 H82 N12 O32
Title of publication	Healable luminescent self-assembly supramolecular metallogels possessing lanthanide (eu/tb) dependent rheological and morphological properties.
Authors of publication	Martínez-Calvo, Miguel; Kotova, Oxana; Möbius, Matthias E; Bell, Alan P.; McCabe, Thomas; Boland, John J.; Gunnlaugsson, Thorfinnur
Journal of publication	Journal of the American Chemical Society
Year of publication	2015
Journal volume	137
Journal issue	5
Pages of publication	1983 - 1992
a	11.998 ± 0.002 Å
b	14.851 ± 0.003 Å
c	12.524 ± 0.003 Å
α	90°
β	93.8 ± 0.03°
γ	90°
Cell volume	2226.6 ± 0.8 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	4
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for significantly intense reflections	0.0513
Weighted residual factors for all reflections included in the refinement	0.1873
Goodness-of-fit parameter for all reflections included in the refinement	1.12
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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