Crystallography Open Database

Information card for entry 7717130

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Coordinates	7717130.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	TR-433-2
Formula	C64 H42 Dy2 F12 N8 O10
Calculated formula	C64 H42 Dy2 F12 N8 O10
Title of publication	Modulating Quantum Tunnelling of Magnetization in Dy isotopologue Dimers
Authors of publication	Ruan, Ting-Ting; Moreno-Pineda, Eufemio; Paul, Sagar; Schulze, Michael; Schlittenhardt, Sören; Mizuno, Asato; Wernsdorfer, Wolfgang; Ruben, Mario
Journal of publication	Dalton Transactions
Year of publication	2024
a	13.5218 ± 0.0005 Å
b	13.948 ± 0.0007 Å
c	18.7575 ± 0.0007 Å
α	92.97 ± 0.003°
β	100.359 ± 0.003°
γ	116.822 ± 0.004°
Cell volume	3069.8 ± 0.3 Å³
Cell temperature	160 K
Ambient diffraction temperature	160 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0679
Residual factor for significantly intense reflections	0.0433
Weighted residual factors for significantly intense reflections	0.0898
Weighted residual factors for all reflections included in the refinement	0.0999
Goodness-of-fit parameter for all reflections included in the refinement	0.985
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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