Crystallography Open Database

Information card for entry 2000627

2000626 << 2000627 >> 2000628

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Coordinates	2000627.cif
Original IUCr paper	HTML

Structure parameters

Formula	C11 H14 O S2
Calculated formula	C11 H14 O S2
Title of publication	<i>syn</i>-2-Benzyl-1,3-dithiane 1-oxide
Authors of publication	Barkley, J.; Harding, M. M.; Kariuki, B. M.; Namwindwa, E. S.; Page, P. C. B.
Journal of publication	Acta Crystallographica Section C
Year of publication	1992
Journal volume	48
Journal issue	9
Pages of publication	1689 - 1690
a	7.598 ± 0.003 Å
b	25.635 ± 0.002 Å
c	5.774 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	1124.6 ± 0.7 Å³
Number of distinct elements	4
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	Mo
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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