Crystallography Open Database

Information card for entry 7201398

7201397 << 7201398 >> 7201399

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Coordinates	7201398.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H50 O22 Sm2
Calculated formula	C24 H30 O19 Sm2
Title of publication	Observation of the least stable conformer of 1,4-cyclohexanedicarboxylic anions in a samarium coordination architecture
Authors of publication	Lü, Jian; Bi, Wen-Hua; Cao, Rong
Journal of publication	CrystEngComm
Year of publication	2009
Journal volume	11
Journal issue	11
Pages of publication	2248
a	10.2001 ± 0.0006 Å
b	10.4146 ± 0.0006 Å
c	10.7531 ± 0.0007 Å
α	111.736 ± 0.001°
β	117.78 ± 0.001°
γ	92.027 ± 0.001°
Cell volume	908.23 ± 0.1 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0631
Residual factor for significantly intense reflections	0.0548
Weighted residual factors for significantly intense reflections	0.1343
Weighted residual factors for all reflections included in the refinement	0.1428
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	Yes
Has F_obs	No

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