Crystallography Open Database

Information card for entry 7226508

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Coordinates	7226508.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C H2 Cl Hg N5
Calculated formula	C H2 Cl Hg N5
Title of publication	Syntheses, structures and investigation of the properties of mercury coordination polymers based on 5-amino-tetrazolate ligands
Authors of publication	Liu, Dong-Sheng; Chen, Wen-Tong; Huang, Jian-Gen; Cheng, Xiao-Di; Wang, Jie; Sui, Yan
Journal of publication	CrystEngComm
Year of publication	2016
Journal volume	18
Journal issue	40
Pages of publication	7865
a	5.8459 ± 0.0013 Å
b	6.9731 ± 0.0015 Å
c	6.1725 ± 0.0013 Å
α	90°
β	94.27 ± 0.002°
γ	90°
Cell volume	250.92 ± 0.09 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.0604
Residual factor for significantly intense reflections	0.054
Weighted residual factors for significantly intense reflections	0.1323
Weighted residual factors for all reflections included in the refinement	0.1405
Goodness-of-fit parameter for all reflections included in the refinement	1.131
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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