Crystallography Open Database

Information card for entry 7230225

Preview

Coordinates	7230225.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C6 H14 Bi2 Cl8 N4 O2
Calculated formula	C6 H14 Bi2 Cl8 N4 O2
Title of publication	Ferroelasticity and piezoelectricity of organic‒inorganic hybrid materials with a one-dimensional anionic structure: so similar, yet so different
Authors of publication	Piecha-Bisiorek, Anna; Mencel, Klaudia; Kinzhybalo, Vasyl; Szota, Aleksandra; Jakubas, Ryszard; Medycki, Wojciech; Zawrocki, Wiktor
Journal of publication	CrystEngComm
Year of publication	2018
Journal volume	20
Journal issue	15
Pages of publication	2112
a	13.773 ± 0.004 Å
b	7.213 ± 0.003 Å
c	21.91 ± 0.006 Å
α	90°
β	107.53 ± 0.03°
γ	90°
Cell volume	2075.6 ± 1.2 Å³
Cell temperature	100 ± 0.1 K
Ambient diffraction temperature	100 ± 0.1 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0437
Residual factor for significantly intense reflections	0.0307
Weighted residual factors for significantly intense reflections	0.0603
Weighted residual factors for all reflections included in the refinement	0.0646
Goodness-of-fit parameter for all reflections included in the refinement	1.044
Diffraction radiation probe	x-ray
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
229092 (current)	2019-11-17	cif/ Updating files of 7230223, 7230224, 7230225 Original log message: Adding full bibliography for 7230223--7230225.cif.	7230225.cif
206755	2018-03-03	cif/ Adding structures of 7230223, 7230224, 7230225 via cif-deposit CGI script.	7230225.cif