Crystallography Open Database

Information card for entry 7059204

Preview

Coordinates	7059204.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48 H55 Er3 N12 O41 Zn3
Calculated formula	C48 H55 Er3 N12 O41 Zn3
Title of publication	Three new heterometallic ZnII‒LnIII complexes with a windmill-like framework and field-induced SMM behavior
Authors of publication	Fan, Xiao-Tian; Yang, Hua; Li, Da-Cheng; Tian, Hai-Quan; Cao, Fan; Dou, Jian-Min
Journal of publication	New Journal of Chemistry
Year of publication	2020
Journal volume	44
Journal issue	6
Pages of publication	2555 - 2560
a	14.9778 ± 0.0012 Å
b	16.24 ± 0.0014 Å
c	19.6798 ± 0.0017 Å
α	87.674 ± 0.002°
β	72.89 ± 0.001°
γ	85.783 ± 0.002°
Cell volume	4561.8 ± 0.7 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 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	0.0576
Residual factor for significantly intense reflections	0.0361
Weighted residual factors for significantly intense reflections	0.1105
Weighted residual factors for all reflections included in the refinement	0.1388
Goodness-of-fit parameter for all reflections included in the refinement	0.511
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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