Crystallography Open Database

Information card for entry 7046535

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Coordinates	7046535.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 H12 Cl2 Cu2 N3
Calculated formula	C18 H12 Cl2 Cu2 N3
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	10.0389 ± 0.0003 Å
b	11.3316 ± 0.0003 Å
c	16.6903 ± 0.0004 Å
α	90°
β	90°
γ	90°
Cell volume	1898.64 ± 0.09 Å³
Cell temperature	298 K
Ambient diffraction temperature	298 K
Number of distinct elements	5
Space group number	58
Hermann-Mauguin space group symbol	P n n m
Hall space group symbol	-P 2 2n
Residual factor for all reflections	0.1121
Residual factor for significantly intense reflections	0.0982
Weighted residual factors for significantly intense reflections	0.2453
Weighted residual factors for all reflections included in the refinement	0.2522
Goodness-of-fit parameter for all reflections included in the refinement	1.823
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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