Crystallography Open Database

Information card for entry 2021109

2021108 << 2021109 >> 2021110

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Structure parameters

Chemical name	Trilanthanum titanium pentabismuthide
Formula	Bi5 La3 Ti
Calculated formula	Bi5 La3 Ti
Title of publication	Undistorted linear Bi chains with hypervalent bonding in La~3~TiBi~5~ from single-crystal X-ray diffraction
Authors of publication	Ovchinnikov, Alexander; Bobev, Svilen
Journal of publication	Acta Crystallographica Section C
Year of publication	2018
Journal volume	74
Journal issue	5
Pages of publication	618 - 622
a	9.6871 ± 0.0013 Å
b	9.6871 Å
c	6.4528 ± 0.0008 Å
α	90°
β	90°
γ	120°
Cell volume	524.4 ± 0.1 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 ± 2 K
Number of distinct elements	3
Space group number	193
Hermann-Mauguin space group symbol	P 63/m c m
Hall space group symbol	-P 6c 2
Residual factor for all reflections	0.0209
Residual factor for significantly intense reflections	0.0185
Weighted residual factors for significantly intense reflections	0.0359
Weighted residual factors for all reflections included in the refinement	0.0365
Goodness-of-fit parameter for all reflections included in the refinement	1.077
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

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