Crystallography Open Database

Information card for entry 4325236

Preview

Coordinates	4325236.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	B3 Bi2 H O8
Calculated formula	B3 Bi2 H O8
Title of publication	Syntheses and Crystal Structures of Two New Bismuth Hydroxyl Borates Containing [Bi2O2]2+ Layers: Bi2O2[B3O5(OH)] and Bi2O2[BO2(OH)]
Authors of publication	Rihong Cong; Junliang Sun; Tao Yang; Mingrun Li; Fuhui Liao; Yingxia Wang; Jianhua Lin
Journal of publication	Inorganic Chemistry
Year of publication	2011
Journal volume	50
Pages of publication	5098 - 5104
a	6.0268 ± 0.0003 Å
b	11.3635 ± 0.0006 Å
c	19.3485 ± 0.001 Å
α	90°
β	90°
γ	90°
Cell volume	1325.09 ± 0.12 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Cell measurement pressure	101 kPa
Number of distinct elements	4
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.0533
Residual factor for significantly intense reflections	0.0393
Weighted residual factors for significantly intense reflections	0.0906
Weighted residual factors for all reflections included in the refinement	0.097
Goodness-of-fit parameter for all reflections included in the refinement	1.118
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
176432 (current)	2016-02-14	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries.	4325236.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4325236.cif
43689	2012-03-15	../uploads/cif-deposit/cod/cif Adding structures of 4325236 via cif-deposit CGI script.	4325236.cif