Crystallography Open Database

Information card for entry 7055384

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Coordinates	7055384.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C70 H91 Cr4 Gd N14 O44
Calculated formula	C70 H51 Cr4 Gd N14 O44
Title of publication	Synthesis, structure, magnetic and magnetocaloric properties of a series of {CrIII4LnIII} complexes
Authors of publication	Blacque, Olivier; Amjad, Asma; Caneschi, Andrea; Sorace, Lorenzo; Car, Pierre-Emmanuel
Journal of publication	New J. Chem.
Year of publication	2016
Journal volume	40
Journal issue	4
Pages of publication	3571
a	16.81501 ± 0.00017 Å
b	24.2384 ± 0.0002 Å
c	22.06575 ± 0.00019 Å
α	90°
β	95.8109 ± 0.0009°
γ	90°
Cell volume	8947.1 ± 0.14 Å³
Cell temperature	183 ± 1 K
Ambient diffraction temperature	183 ± 1 K
Number of distinct elements	6
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	0.0594
Residual factor for significantly intense reflections	0.047
Weighted residual factors for significantly intense reflections	0.1247
Weighted residual factors for all reflections included in the refinement	0.1347
Goodness-of-fit parameter for all reflections included in the refinement	1.037
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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