Crystallography Open Database

Information card for entry 4003953

Preview

Coordinates	4003953.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	As Cs0.11 Si0.95 Zn0.05
Calculated formula	As Cs0.109333 Si0.951 Zn0.049
Title of publication	Two-Dimensional and Three-Dimensional Tetrel-Arsenide Frameworks Templated by Li and Cs Cations
Authors of publication	Mark, Justin; Woo, Katherine E.; Zhu, Weidi; Ji, Bingheng; Lee, Shannon J.; Adeyemi, Adedoyin N.; Sen, Sabyasachi; Kovnir, Kirill
Journal of publication	Chemistry of Materials
Year of publication	2021
Journal volume	33
Journal issue	12
Pages of publication	4586 - 4595
a	35.201 ± 0.003 Å
b	3.6649 ± 0.0003 Å
c	9.9848 ± 0.0009 Å
α	90°
β	91.863 ± 0.002°
γ	90°
Cell volume	1287.44 ± 0.19 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	4
Space group number	12
Hermann-Mauguin space group symbol	C 1 2/m 1
Hall space group symbol	-C 2y
Residual factor for all reflections	0.0619
Residual factor for significantly intense reflections	0.0392
Weighted residual factors for significantly intense reflections	0.0619
Weighted residual factors for all reflections included in the refinement	0.0662
Goodness-of-fit parameter for all reflections included in the refinement	1.117
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
266967 (current)	2021-07-04	cif/ Updating files of 4003953, 4003954 Original log message: Adding full bibliography for 4003953--4003954.cif.	4003953.cif
266369	2021-06-11	cif/ Adding structures of 4003953 via cif-deposit CGI script.	4003953.cif