Crystallography Open Database

Information card for entry 4336643

Preview

Coordinates	4336643.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Cl1.25 Ge0.5 O3.25 Pb2.88
Calculated formula	Cl1.25 Ge0.5 O3.25 Pb2.875
Title of publication	Synthesis and Modular Structural Architectures of Mineralogically Inspired Novel Complex Pb Oxyhalides
Authors of publication	Oleg I. Siidra; Diana O. Zinyakhina; Anastasiya I. Zadoya; Sergey V. Krivovichev; Rick W. Turner
Journal of publication	Inorganic Chemistry
Year of publication	2013
Journal volume	52
Pages of publication	12799 - 12805
a	28.352 ± 0.019 Å
b	11.116 ± 0.007 Å
c	16.513 ± 0.011 Å
α	90°
β	90°
γ	90°
Cell volume	5204 ± 6 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	4
Space group number	64
Hermann-Mauguin space group symbol	C m c a
Hall space group symbol	-C 2ac 2
Residual factor for all reflections	0.096
Residual factor for significantly intense reflections	0.0504
Weighted residual factors for significantly intense reflections	0.1122
Weighted residual factors for all reflections included in the refinement	0.1338
Goodness-of-fit parameter for all reflections included in the refinement	0.99
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
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4336643.cif
102650	2014-02-21	cif/ Adding structures of 4336643 via cif-deposit CGI script.	4336643.cif