Crystallography Open Database

Information card for entry 7059333

Preview

Coordinates	7059333.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C72 H86 N14 Nd2 O18
Calculated formula	C72 H86 N14 Nd2 O18
Title of publication	Lanthanide clusters as highly efficient catalysts regarding carbon dioxide activation
Authors of publication	Hou, Wei; Wang, Gang; Wu, Xiaojing; Sun, Shuoyi; Zhao, Chunyang; Liu, Wei-Sheng; Pan, Fuxing
Journal of publication	New Journal of Chemistry
Year of publication	2020
Journal volume	44
Journal issue	13
Pages of publication	5019 - 5022
a	17.7253 ± 0.0015 Å
b	27.7358 ± 0.0015 Å
c	17.9572 ± 0.0017 Å
α	90°
β	117.705 ± 0.011°
γ	90°
Cell volume	7816.1 ± 1.3 Å³
Cell temperature	100 ± 0.1 K
Ambient diffraction temperature	100 ± 0.1 K
Number of distinct elements	5
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	0.1068
Residual factor for significantly intense reflections	0.0725
Weighted residual factors for significantly intense reflections	0.1306
Weighted residual factors for all reflections included in the refinement	0.1475
Goodness-of-fit parameter for all reflections included in the refinement	1.071
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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