Crystallography Open Database

Information card for entry 7134516

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Coordinates	7134516.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C62 H54 N6 O4 P2 Re
Calculated formula	C62 H54 N6 O4 P2 Re
Title of publication	Decanuclear {CuI6ReV4} clusters utilizing cyanido and nitrido molecular bridges as efficient ligand-modulated luminophores
Authors of publication	Liberka, Michal; Gas, Piotr; Chorazy, Szymon
Journal of publication	Chemical Communications
Year of publication	2025
Journal volume	61
Journal issue	47
Pages of publication	8580 - 8583
a	13.4644 ± 0.0019 Å
b	17.279 ± 0.003 Å
c	13.82 ± 0.003 Å
α	90°
β	119.085 ± 0.004°
γ	90°
Cell volume	2809.8 ± 0.9 Å³
Cell temperature	125 ± 2 K
Ambient diffraction temperature	125 ± 2 K
Number of distinct elements	6
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.1267
Residual factor for significantly intense reflections	0.0889
Weighted residual factors for significantly intense reflections	0.169
Weighted residual factors for all reflections included in the refinement	0.1879
Goodness-of-fit parameter for all reflections included in the refinement	1.069
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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