Crystallography Open Database

Information card for entry 1572819

Preview

Coordinates	1572819.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C5 H13 Br5 Ga N
Calculated formula	C5 H13 Br5 Ga N
Title of publication	Enhancing the performance of molecule-based piezoelectric sensors by optimizing their microstructures.
Authors of publication	Tang, Zheng-Xiao; Wang, Bin; Li, Zhi-Rui; Huang, Zhuo; Zhao, Hai-Xia; Long, La-Sheng; Zheng, Lan-Sun
Journal of publication	Chemical science
Year of publication	2024
Journal volume	15
Journal issue	43
Pages of publication	18060 - 18066
a	8.5264 ± 0.0003 Å
b	12.9009 ± 0.0003 Å
c	13.416 ± 0.0004 Å
α	90°
β	90°
γ	90°
Cell volume	1475.74 ± 0.08 Å³
Cell temperature	300 ± 0.1 K
Ambient diffraction temperature	300 ± 0.1 K
Number of distinct elements	5
Space group number	36
Hermann-Mauguin space group symbol	C m c 21
Hall space group symbol	C 2c -2
Residual factor for all reflections	0.0491
Residual factor for significantly intense reflections	0.0455
Weighted residual factors for significantly intense reflections	0.1144
Weighted residual factors for all reflections included in the refinement	0.1167
Goodness-of-fit parameter for all reflections included in the refinement	1.092
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
296375 (current)	2024-12-06	cif/ Updating files of 1572819 Original log message: Adding full bibliography for 1572819.cif.	1572819.cif
295400	2024-10-10	cif/ Adding structures of 1572819 via cif-deposit CGI script.	1572819.cif