Crystallography Open Database

Information card for entry 4342018

4342017 << 4342018 >> 4342019

Preview

Coordinates	4342018.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 Br6 Cu6.577 N8
Calculated formula	C24 Br6 Cu6.57688 N8.00016
Title of publication	A new class of cuprous bromide cluster-based hybrid materials: direct observation of the stepwise replacement of hydrogen bonds by coordination bonds.
Authors of publication	Zhang, Xian-Ming; Hou, Juan-Juan; Guo, Cai-Hong; Li, Chun-Fang
Journal of publication	Inorganic chemistry
Year of publication	2015
Journal volume	54
Journal issue	2
Pages of publication	554 - 559
a	13.5838 ± 0.0004 Å
b	13.5838 ± 0.0004 Å
c	13.5838 ± 0.0004 Å
α	90°
β	90°
γ	90°
Cell volume	2506.48 ± 0.13 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298.15 K
Number of distinct elements	4
Space group number	229
Hermann-Mauguin space group symbol	I m -3 m
Hall space group symbol	-I 4 2 3
Residual factor for all reflections	0.078246
Residual factor for significantly intense reflections	0.065596
Weighted residual factors for all reflections included in the refinement	0.183591
Goodness-of-fit parameter for all reflections included in the refinement	0.993825
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
179523 (current)	2016-03-24	cif/4/34/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/34/20.	4342018.cif
130511	2015-02-04	cif/ Updating files of 4342013, 4342014, 4342015, 4342016, 4342017, 4342018, 4342019, 4342020 Original log message: Adding full bibliography for 4342013--4342020.cif.	4342018.cif
129159	2014-12-30	cif/ Adding structures of 4342013, 4342014, 4342015, 4342016, 4342017, 4342018, 4342019, 4342020 via cif-deposit CGI script.	4342018.cif