Crystallography Open Database

Information card for entry 2312499

Preview

Coordinates	2312499.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Ge4.158 N4 O4 Sn0.842
Calculated formula	Ge4.16 N4 O4 Sn0.84
Title of publication	Crystal structures of two new high-pressure oxynitrides with composition SnGe<sub>4</sub>N<sub>4</sub>O<sub>4</sub>, from single-crystal electron diffraction.
Authors of publication	Gollé-Leidreiter, Philipp; Bhat, Shrikant; Wiehl, Leonore; Wen, Qingbo; Kroll, Peter; Ishikawa, Ryo; Etter, Martin; Farla, Robert; Ikuhara, Yuichi; Riedel, Ralf; Kolb, Ute
Journal of publication	Acta crystallographica Section B, Structural science, crystal engineering and materials
Year of publication	2024
Journal volume	80
Journal issue	3
a	5.839 ± 0.001 Å
b	5.839 ± 0.001 Å
c	9.365 ± 0.002 Å
α	90°
β	90°
γ	120°
Cell volume	276.51 ± 0.09 Å³
Ambient diffraction temperature	293 K
Number of distinct elements	4
Space group number	186
Hermann-Mauguin space group symbol	P 63 m c
Hall space group symbol	P 6c -2c
Residual factor for all reflections	0.1158
Residual factor for significantly intense reflections	0.1125
Weighted residual factors for significantly intense reflections	0.1333
Weighted residual factors for all reflections included in the refinement	0.1337
Goodness-of-fit parameter for significantly intense reflections	4.9125
Goodness-of-fit parameter for all reflections included in the refinement	4.8307
Diffraction radiation probe	electron
Diffraction radiation wavelength	0.0197 Å
Diffraction radiation type	electron
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
291814 (current)	2024-05-11	cif/ Adding structures of 2312498, 2312499, 2312500, 2312501 via cif-deposit CGI script.	2312499.cif