Crystallography Open Database

Information card for entry 4344053

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Coordinates	4344053.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Ba3 Cl La6 N29 O2 Si17
Calculated formula	Ba3 Cl La6 N29 O2 Si17
Title of publication	La6Ba3[Si17N29O2]Cl-An Oxonitridosilicate Chloride with Exceptional Structural Motifs.
Authors of publication	Durach, Dajana; Fahrnbauer, Felix; Oeckler, Oliver; Schnick, Wolfgang
Journal of publication	Inorganic chemistry
Year of publication	2015
Journal volume	54
Journal issue	17
Pages of publication	8727 - 8732
a	9.8117 ± 0.0014 Å
b	9.8117 ± 0.0014 Å
c	19.286 ± 0.006 Å
α	90°
β	90°
γ	120°
Cell volume	1607.9 ± 0.6 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	6
Space group number	176
Hermann-Mauguin space group symbol	P 63/m
Hall space group symbol	-P 6c
Residual factor for all reflections	0.0171
Residual factor for significantly intense reflections	0.0169
Weighted residual factors for significantly intense reflections	0.0396
Weighted residual factors for all reflections included in the refinement	0.0397
Goodness-of-fit parameter for all reflections included in the refinement	1.302
Diffraction radiation wavelength	0.3351 Å
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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