Crystallography Open Database

Information card for entry 4103825

Preview

Coordinates	4103825.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Br3 Tc
Calculated formula	Br3 Tc
SMILES	[Tc+3].[Br-].[Br-].[Br-]
Title of publication	Preparation of the Binary Technetium Bromides: TcBr3 and TcBr4
Authors of publication	Frederic Poineau; Efrain E. Rodriguez; Paul M. Forster; Alfred P. Sattelberger; Anthony K. Cheetham; Kenneth R. Czerwinski
Journal of publication	Journal of the American Chemical Society
Year of publication	2009
Journal volume	131
Pages of publication	910 - 911
a	11.0618 ± 0.0018 Å
b	5.9755 ± 0.001 Å
c	6.3873 ± 0.0011 Å
α	90°
β	90°
γ	90°
Cell volume	422.2 ± 0.12 Å³
Cell temperature	149 ± 2 K
Ambient diffraction temperature	149 ± 2 K
Number of distinct elements	2
Space group number	59
Hermann-Mauguin space group symbol	P m m n :2
Hall space group symbol	-P 2ab 2a
Residual factor for all reflections	0.0777
Residual factor for significantly intense reflections	0.062
Weighted residual factors for significantly intense reflections	0.1799
Weighted residual factors for all reflections included in the refinement	0.1887
Goodness-of-fit parameter for all reflections included in the refinement	1.028
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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