Crystallography Open Database

Information card for entry 7210249

Preview

Coordinates	7210249.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C168 H408 Co17 In32 N56 O6 S68
Calculated formula	C132 Co17 In32 N52 O6 S68
Title of publication	Polymeric supertetrahedral InS clusters assembled by new linkages
Authors of publication	Wang, Yu-Hong; Jiang, Jian-Bing; Wang, Peng; Sun, Xiao-Lu; Zhu, Qin-Yu; Dai, Jie
Journal of publication	CrystEngComm
Year of publication	2013
Journal volume	15
Journal issue	30
Pages of publication	6040
a	22.9417 ± 0.001 Å
b	26.2387 ± 0.001 Å
c	27.3488 ± 0.0011 Å
α	90°
β	99.454 ± 0.001°
γ	90°
Cell volume	16239.3 ± 1.1 Å³
Cell temperature	223 ± 2 K
Ambient diffraction temperature	223 ± 2 K
Number of distinct elements	7
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.1141
Residual factor for significantly intense reflections	0.0814
Weighted residual factors for significantly intense reflections	0.1798
Weighted residual factors for all reflections included in the refinement	0.202
Goodness-of-fit parameter for all reflections included in the refinement	1.132
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
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/7210249.html