Crystallography Open Database

Information card for entry 7704752

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Coordinates	7704752.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Cl5 Cu4 Na O6 Te2
Calculated formula	Cl5 Cu4 Na O6 Te2
Title of publication	Synthesis, crystal structures, and magnetic properties of one-dimensional alkali metal copper chlor-tellurites A(NH<sub>4</sub>)Cu<sub>4</sub>Te<sub>2</sub>O<sub>6</sub>Cl<sub>6</sub> (A = K, Cs), NaCu<sub>4</sub>Te<sub>2</sub>Cl<sub>5</sub>O<sub>6</sub> and Rb<sub>3</sub>(NH<sub>4</sub>)<sub>2</sub>Cu<sub>12</sub>Te<sub>6</sub>Cl<sub>16.5</sub>O<sub>18</sub>(OH)<sub>0.5</sub>.
Authors of publication	Zhu, Bei; Jiang, Jianhua; Zhu, Tianyu; Yang, Haoming; Jin, Yong; Lü, Minfeng
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2020
Journal volume	49
Journal issue	28
Pages of publication	9751 - 9761
a	8.5293 ± 0.0004 Å
b	9.253 ± 0.0004 Å
c	10.6835 ± 0.0005 Å
α	90°
β	105.676 ± 0.004°
γ	90°
Cell volume	811.8 ± 0.07 Å³
Cell temperature	293 K
Ambient diffraction temperature	293 K
Number of distinct elements	5
Space group number	12
Hermann-Mauguin space group symbol	C 1 2/m 1
Hall space group symbol	-C 2y
Residual factor for all reflections	0.081
Residual factor for significantly intense reflections	0.0518
Weighted residual factors for significantly intense reflections	0.0657
Weighted residual factors for all reflections included in the refinement	0.0677
Goodness-of-fit parameter for significantly intense reflections	2.69
Goodness-of-fit parameter for all reflections included in the refinement	2.34
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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