Crystallography Open Database

Information card for entry 4349153

Preview

Coordinates	4349153.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Ag2 B12 F12 H8 O4
Calculated formula	Ag2 B12 F12 H8 O4
Title of publication	Structures of M<sub>2</sub>(SO<sub>2</sub>)<sub>6</sub>B<sub>12</sub>F<sub>12</sub> (M = Ag or K) and Ag<sub>2</sub>(H<sub>2</sub>O)<sub>4</sub>B<sub>12</sub>F<sub>12</sub>: Comparison of the Coordination of SO<sub>2</sub> versus H<sub>2</sub>O and of B<sub>12</sub>F<sub>12</sub><sup>2-</sup> versus Other Weakly Coordinating Anions to Metal Ions in the Solid State.
Authors of publication	Malischewski, Moritz; Peryshkov, Dmitry V.; Bukovsky, Eric V.; Seppelt, Konrad; Strauss, Steven H.
Journal of publication	Inorganic chemistry
Year of publication	2016
Journal volume	55
Journal issue	23
Pages of publication	12254 - 12262
a	10.4428 ± 0.0007 Å
b	10.9458 ± 0.0005 Å
c	14.0126 ± 0.0007 Å
α	90°
β	93.089 ± 0.001°
γ	90°
Cell volume	1599.38 ± 0.15 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0786
Residual factor for significantly intense reflections	0.0443
Weighted residual factors for significantly intense reflections	0.1114
Weighted residual factors for all reflections included in the refinement	0.1411
Goodness-of-fit parameter for all reflections included in the refinement	0.783
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4349153.html