Crystallography Open Database

Information card for entry 7715994

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Coordinates	7715994.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C30 H22 Ce F9 O8
Calculated formula	C30 H22 Ce F9 O8
Title of publication	New series of Mononuclear β-diketonate Cerium(III) Field Induced Single-Molecule Magnets
Authors of publication	Tubau, Ànnia; Gómez-Coca, Silvia; Speed, Saskia; Font-Bardia, Merce; Vicente, Ramon
Journal of publication	Dalton Transactions
Year of publication	2024
a	10.8548 ± 0.0016 Å
b	13.219 ± 0.002 Å
c	23.317 ± 0.004 Å
α	90°
β	90°
γ	90°
Cell volume	3345.7 ± 0.9 Å³
Cell temperature	294 ± 2 K
Ambient diffraction temperature	294 ± 2 K
Number of distinct elements	5
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for all reflections	0.0659
Residual factor for significantly intense reflections	0.0527
Weighted residual factors for significantly intense reflections	0.1414
Weighted residual factors for all reflections included in the refinement	0.1523
Goodness-of-fit parameter for all reflections included in the refinement	1.056
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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