Crystallography Open Database

Information card for entry 4321034

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Coordinates	4321034.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C12 H24 S2 Se2
Calculated formula	C12 H24 S2 Se2
Title of publication	Synthesis, Characterization, and Redox Behavior of New Selenium Coronands and of Copper(I) and Copper(II) Complexes of Selenium Coronands
Authors of publication	Raymond J. Batchelor; Frederick W. B. Einstein; Ian D. Gay; Jian-Hua Gu; Seema Mehta; B. Mario Pinto; Xue-Min Zhou
Journal of publication	Inorganic Chemistry
Year of publication	2000
Journal volume	39
Pages of publication	2558 - 2571
a	24.202 ± 0.009 Å
b	18.005 ± 0.007 Å
c	16.235 ± 0.005 Å
α	90°
β	138.23 ± 0.03°
γ	90°
Cell volume	4713 ± 4 Å³
Cell temperature	200 K
Ambient diffraction temperature	200 K
Number of distinct elements	4
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for significantly intense reflections	0.052
Weighted residual factors for significantly intense reflections	0.062
Diffraction radiation wavelength	0.7093 Å
Diffraction radiation type	MolybdenumKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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