Crystallography Open Database

Information card for entry 7122933

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Coordinates	7122933.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C22 H20 Co N6 S1.11 Se0.89
Calculated formula	C22 H20 Co N6 S1.112 Se0.888
Title of publication	Tuning of the exchange interaction and the Curie temperature by mixed crystal formation of the bridging anionic ligands
Authors of publication	Neumann, Tristan; Rams, Michał; Tomkowicz, Zbigniew; Jess, Inke; Nather, Christian
Journal of publication	Chemical Communications
Year of publication	2019
a	12.3648 ± 0.0005 Å
b	13.1112 ± 0.0004 Å
c	15.0007 ± 0.0006 Å
α	90°
β	108.097 ± 0.003°
γ	90°
Cell volume	2311.57 ± 0.15 Å³
Cell temperature	170 ± 2 K
Ambient diffraction temperature	170 ± 2 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0418
Residual factor for significantly intense reflections	0.0368
Weighted residual factors for significantly intense reflections	0.0926
Weighted residual factors for all reflections included in the refinement	0.0953
Goodness-of-fit parameter for all reflections included in the refinement	1.04
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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