Crystallography Open Database

Information card for entry 1567254

Preview

Coordinates	1567254.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C6 H8 Ag Br N2
Calculated formula	C6 H8 Ag Br N2
Title of publication	AgX-based hybrid coordination polymers: mechanochemical synthesis, structure and luminescence property characterization.
Authors of publication	Zuffa, Caterina; Cappuccino, Chiara; Marchini, Marianna; Contini, Laura; Farinella, Francesco; Maini, Lucia
Journal of publication	Faraday discussions
Year of publication	2023
Journal volume	241
Journal issue	0
Pages of publication	448 - 465
a	4.3871 ± 0.0005 Å
b	10.1081 ± 0.0012 Å
c	10.251 ± 0.0018 Å
α	113.498 ± 0.014°
β	97.081 ± 0.012°
γ	93.535 ± 0.009°
Cell volume	410.63 ± 0.11 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0717
Residual factor for significantly intense reflections	0.0448
Weighted residual factors for significantly intense reflections	0.0725
Weighted residual factors for all reflections included in the refinement	0.0854
Goodness-of-fit parameter for all reflections included in the refinement	0.983
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
288248 (current)	2023-12-12	cif/ Removed the misspelt '_symmetry_space_group_name_h-m_alt' data name since the same space group information is already provided using proper data names.	1567254.cif
281467	2023-03-04	cif/ Updating files of 1567249, 1567250, 1567251, 1567252, 1567253, 1567254 Original log message: Adding full bibliography for 1567249--1567254.cif.	1567254.cif
276721	2022-07-07	cif/ Adding structures of 1567254 via cif-deposit CGI script.	1567254.cif