Crystallography Open Database

Information card for entry 7046536

Preview

Coordinates	7046536.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C46 H42 Cl4 Cu4 N8
Calculated formula	C46 H42 Cl4 Cu4 N8
Title of publication	Static and dynamic coordination behaviours of copper(i) ions in hexa(2-pyridyl)benzene ligand systems.
Authors of publication	Kwon, Hyunchul; Lee, Eunsung
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2018
Journal volume	47
Journal issue	25
Pages of publication	8448 - 8455
a	11.435 ± 0.004 Å
b	24.695 ± 0.009 Å
c	17.511 ± 0.006 Å
α	90°
β	108.053 ± 0.011°
γ	90°
Cell volume	4701 ± 3 Å³
Cell temperature	100 K
Ambient diffraction temperature	100 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0725
Residual factor for significantly intense reflections	0.0505
Weighted residual factors for significantly intense reflections	0.1361
Weighted residual factors for all reflections included in the refinement	0.1497
Goodness-of-fit parameter for all reflections included in the refinement	1.073
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7046536.html