Crystallography Open Database

Information card for entry 7708328

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Coordinates	7708328.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C56 H54 N8 O71 Si Tb4 W12
Calculated formula	C56 H54 N8 O71 Si Tb4 W12
Title of publication	Dalton technical issue “Lanthanide and transition metal complexes as molecular magnets Single-molecule magnets within polyoxometalate-based frameworks
Authors of publication	Babaei Zarch, Malihe; Mirzaei, Masoud; Bazargan, Maryam; Gupta, Sandeep K.; Meyer, Franc; Mague, Joel T.
Journal of publication	Dalton Transactions
Year of publication	2021
a	33.4692 ± 0.0015 Å
b	13.8243 ± 0.0006 Å
c	21.0185 ± 0.001 Å
α	90°
β	97.518 ± 0.001°
γ	90°
Cell volume	9641.4 ± 0.8 Å³
Cell temperature	235 ± 2 K
Ambient diffraction temperature	235 ± 2 K
Number of distinct elements	7
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	0.0905
Residual factor for significantly intense reflections	0.0633
Weighted residual factors for significantly intense reflections	0.1226
Weighted residual factors for all reflections included in the refinement	0.1321
Goodness-of-fit parameter for all reflections included in the refinement	1.126
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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