Crystallography Open Database

Information card for entry 7116679

Preview

Coordinates	7116679.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Ge3.88 In22.12 O Se50
Calculated formula	Ge3.84 In22.16 O Se50
Title of publication	A hybrid linkage mode between T2,2 and T3 selenide clusters
Authors of publication	Han, Xiaohui; Xu, Jin; Wang, Zhenqing; Liu, Dan; Wang, Cheng
Journal of publication	Chemical Communications (Cambridge, United Kingdom)
Year of publication	2015
Journal volume	51
Journal issue	18
Pages of publication	3919 - 3922
a	22.4956 ± 0.001 Å
b	22.4956 ± 0.001 Å
c	37.984 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	19221.9 ± 1.9 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	4
Space group number	88
Hermann-Mauguin space group symbol	I 41/a :2
Hall space group symbol	-I 4ad
Residual factor for all reflections	0.1548
Residual factor for significantly intense reflections	0.0691
Weighted residual factors for significantly intense reflections	0.2078
Weighted residual factors for all reflections included in the refinement	0.2609
Goodness-of-fit parameter for all reflections included in the refinement	1.043
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Duplicate of	7116592
Has coordinates	Yes
Has disorder	No
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7116679.html