Crystallography Open Database

Information card for entry 4105980

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Coordinates	4105980.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C64 H104 Si4 Tm4
Calculated formula	C64 H104 Si4 Tm4
Title of publication	Ln4(CH2)4 Cubane-Type Rare-Earth Methylidene Complexes Consisting of "(C5Me4SiMe3)LnCH2" Units (Ln = Tm, Lu)
Authors of publication	Wen-Xiong Zhang; Zitao Wang; Masayoshi Nishiura; Zhenfeng Xi; Zhaomin Hou
Journal of publication	Journal of the American Chemical Society
Year of publication	2011
Journal volume	133
Pages of publication	5712 - 5715
a	12.3134 ± 0.0014 Å
b	23.365 ± 0.003 Å
c	13.4173 ± 0.0016 Å
α	90°
β	115.752 ± 0.001°
γ	90°
Cell volume	3476.8 ± 0.7 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	4
Space group number	11
Hermann-Mauguin space group symbol	P 1 21/m 1
Hall space group symbol	-P 2yb
Residual factor for all reflections	0.0406
Residual factor for significantly intense reflections	0.0295
Weighted residual factors for significantly intense reflections	0.0623
Weighted residual factors for all reflections included in the refinement	0.065
Goodness-of-fit parameter for all reflections included in the refinement	0.997
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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