Crystallography Open Database

Information card for entry 7030284

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Coordinates	7030284.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C2 H4 Ba O6 S2
Calculated formula	C2 H4 Ba O6 S2
Title of publication	Solvothermal synthesis and characterization of two inorganic-organic hybrid materials based on barium.
Authors of publication	Abdollahian, Yashar; Hauser, Jesse L.; Rogow, David L.; Oliver, Allen G.; Oliver, Scott R. J.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2012
Journal volume	41
Journal issue	40
Pages of publication	12630 - 12634
a	6.259 ± 0.0017 Å
b	8.266 ± 0.002 Å
c	7.411 ± 0.002 Å
α	90°
β	90°
γ	90°
Cell volume	383.42 ± 0.17 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	5
Space group number	31
Hermann-Mauguin space group symbol	P m n 21
Hall space group symbol	P 2ac -2
Residual factor for all reflections	0.0345
Residual factor for significantly intense reflections	0.0335
Weighted residual factors for significantly intense reflections	0.0837
Weighted residual factors for all reflections included in the refinement	0.0838
Goodness-of-fit parameter for all reflections included in the refinement	1.22
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
180008 (current)	2016-03-25	cif/7/03/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/03/02.	7030284.cif
111586	2014-04-25	cif/ Adding structures of 7030283, 7030284 via cif-deposit CGI script.	7030284.cif