Crystallography Open Database

Information card for entry 7119720

7119719 << 7119720 >> 7119721

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Coordinates	7119720.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C76 H108 Gd2 K2 N2 O7
Calculated formula	C76 H108 Gd2 K2 N2 O7
Title of publication	Strong direct exchange coupling and single-molecule magnetism in indigo-bridged lanthanide dimers.
Authors of publication	Guo, Fu-Sheng; Layfield, Richard A.
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2017
Journal volume	53
Journal issue	21
Pages of publication	3130 - 3133
a	16.6471 ± 0.0013 Å
b	11.6604 ± 0.0004 Å
c	26.166 ± 0.002 Å
α	90°
β	134.109 ± 0.014°
γ	90°
Cell volume	3646.9 ± 1 Å³
Cell temperature	150.03 ± 0.1 K
Ambient diffraction temperature	150.03 ± 0.1 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0458
Residual factor for significantly intense reflections	0.0352
Weighted residual factors for significantly intense reflections	0.0673
Weighted residual factors for all reflections included in the refinement	0.0743
Goodness-of-fit parameter for all reflections included in the refinement	1.054
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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