Crystallography Open Database

Information card for entry 1573843

Preview

Coordinates	1573843.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Hg3 N2 O16 Te4
Calculated formula	Hg3 N2 O16 Te4
Title of publication	"All-four-in-one": a novel mercury tellurite-nitrate Hg<sub>3</sub>(TeO<sub>3</sub>)(Te<sub>3</sub>O<sub>7</sub>)(NO<sub>3</sub>)<sub>2</sub> exhibiting exceptional optical anisotropy.
Authors of publication	Tang, Ru-Ling; Lv, Yi-Lei; Ma, Liang; Miao, Bing-Wei; Liu, Wenlong; Guo, Sheng-Ping
Journal of publication	Chemical science
Year of publication	2025
Journal volume	16
Journal issue	11
Pages of publication	4749 - 4754
a	9.2209 ± 0.0007 Å
b	8.3046 ± 0.0006 Å
c	19.3943 ± 0.0015 Å
α	90°
β	90°
γ	90°
Cell volume	1485.14 ± 0.19 Å³
Cell temperature	296 K
Ambient diffraction temperature	296 K
Number of distinct elements	4
Space group number	62
Hermann-Mauguin space group symbol	P n m a
Hall space group symbol	-P 2ac 2n
Residual factor for all reflections	0.0413
Residual factor for significantly intense reflections	0.0318
Weighted residual factors for significantly intense reflections	0.0561
Weighted residual factors for all reflections included in the refinement	0.0586
Goodness-of-fit parameter for all reflections included in the refinement	1.12
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
298813 (current)	2025-04-05	cif/ Updating files of 1573843 Original log message: Adding full bibliography for 1573843.cif.	1573843.cif
297578	2025-02-04	cif/ Adding structures of 1573843 via cif-deposit CGI script.	1573843.cif