Crystallography Open Database

Information card for entry 7058797

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Coordinates	7058797.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H26 O4 P2 S4
Calculated formula	C20 H26 O4 P2 S4
Title of publication	Medium-sized cyclic bis(anisylphosphonothioyl)disulfanes and their corresponding cyclic sulfane-structures and most characteristic reactions
Authors of publication	Przychodzeń, Witold; Chojnacki, Jarosław; Nierzwicki, Łukasz
Journal of publication	New Journal of Chemistry
Year of publication	2019
Journal volume	43
Journal issue	38
Pages of publication	15413
a	10.4186 ± 0.0013 Å
b	10.5778 ± 0.0011 Å
c	12.5703 ± 0.0015 Å
α	71.9 ± 0.009°
β	67.807 ± 0.009°
γ	82.881 ± 0.009°
Cell volume	1219.2 ± 0.3 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0745
Residual factor for significantly intense reflections	0.0681
Weighted residual factors for significantly intense reflections	0.178
Weighted residual factors for all reflections included in the refinement	0.1934
Goodness-of-fit parameter for all reflections included in the refinement	1.066
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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