Crystallography Open Database

Information card for entry 1562709

Preview

Coordinates	1562709.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Bi9 Cl O18 P2
Calculated formula	Bi9 Cl O18 P2
Title of publication	Novel bismuth oxophosphate halides [Bi8O8][BiO2](PO4)2X (X=Cl, Br) based on oxocentered 2D blocks and their relationships to the Aurivillius phases
Authors of publication	Kozin, Michael S.; Aliev, Almaz; Colmont, Marie; Mentré, Olivier; Siidra, Oleg I.; Krivovichev, Sergey V.
Journal of publication	Journal of Solid State Chemistry
Year of publication	2013
Journal volume	199
Pages of publication	56 - 61
a	17.9512 ± 0.0006 Å
b	5.3972 ± 0.0002 Å
c	22.9264 ± 0.0006 Å
α	90°
β	125.708 ± 0.002°
γ	90°
Cell volume	1803.66 ± 0.11 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
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	0.0414
Residual factor for significantly intense reflections	0.0246
Weighted residual factors for significantly intense reflections	0.0409
Weighted residual factors for all reflections included in the refinement	0.0448
Goodness-of-fit parameter for all reflections included in the refinement	1.011
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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