Crystallography Open Database

Information card for entry 2022680

2022679 << 2022680 >> 2022681

Preview

Coordinates	2022680.cif
Original IUCr paper	HTML

Structure parameters

Chemical name	Dirhodium trisulfide
Formula	Rh2 S3
Calculated formula	Rh2 S3
Title of publication	Single-crystal structure refinements and Debye temperatures of Ir2S3 kashinite and Rh2S3 bowieite
Authors of publication	Yoshiasa, Akira; Kitahara, Ginga; Tokuda, Makoto; Ishimaru, Satoko; Ono, Shin-ichiro; Terai, Kunihisa; Nakatsuka, Akihiko; Sugiyama, Kazumasa
Journal of publication	Acta Crystallographica Section C Structural Chemistry
Year of publication	2022
Journal volume	78
Journal issue	11
a	8.4672 ± 0.0003 Å
b	5.98537 ± 0.00018 Å
c	6.13921 ± 0.00019 Å
α	90°
β	90°
γ	90°
Cell volume	311.131 ± 0.017 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	2
Space group number	60
Hermann-Mauguin space group symbol	P b c n
Hall space group symbol	-P 2n 2ab
Residual factor for all reflections	0.021
Residual factor for significantly intense reflections	0.0176
Weighted residual factors for significantly intense reflections	0.044
Weighted residual factors for all reflections included in the refinement	0.0451
Goodness-of-fit parameter for all reflections included in the refinement	1.14
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
278481 (current)	2022-10-07	cif/ hkl/ Adding structures of 2022679, 2022680 via cif-deposit CGI script.	2022680.cif