Crystallography Open Database

Information card for entry 1561147

Preview

Coordinates	1561147.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	B H O7 Pb2 S
Calculated formula	B H O7 Pb2 S
Title of publication	Pb4(BO3)2(SO4) and Pb2[(BO2)(OH)](SO4): New lead(II) borate-sulfate mixed-anion compounds with two types of 3D network structures
Authors of publication	Ruan, Ting-Ting; Wang, Wen-Wen; Hu, Chun-Li; Xu, Xiang; Mao, Jiang-Gao
Journal of publication	Journal of Solid State Chemistry
Year of publication	2018
Journal volume	260
Pages of publication	39 - 45
a	6.9817 ± 0.0012 Å
b	5.3917 ± 0.0008 Å
c	8.1666 ± 0.0019 Å
α	90°
β	98.643 ± 0.019°
γ	90°
Cell volume	303.93 ± 0.1 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293.2 ± 0.1 K
Number of distinct elements	5
Space group number	11
Hermann-Mauguin space group symbol	P 1 21/m 1
Hall space group symbol	-P 2yb
Residual factor for all reflections	0.0408
Residual factor for significantly intense reflections	0.0355
Weighted residual factors for significantly intense reflections	0.0838
Weighted residual factors for all reflections included in the refinement	0.0878
Goodness-of-fit parameter for all reflections included in the refinement	1.023
Diffraction radiation probe	x-ray
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/1561147.html