Crystallography Open Database

Information card for entry 7061293

Preview

Coordinates	7061293.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48 H38 N4 O10 S2 Zn3
Calculated formula	C48 H38 N4 O10 S2 Zn3
Title of publication	Acetonitrile-induced structure fine-tuning of a trinuclear zinc complex showing multistimuli responsive luminescence
Authors of publication	Zheng, Han-Wen; Yang, Dong-Dong; Liang, Qiong-Fang; Zheng, Xiang-Jun
Journal of publication	New Journal of Chemistry
Year of publication	2022
Journal volume	46
Journal issue	10
Pages of publication	4800 - 4805
a	8.8054 ± 0.0001 Å
b	9.7676 ± 0.0001 Å
c	26.3853 ± 0.0003 Å
α	90°
β	90.928 ± 0.001°
γ	90°
Cell volume	2269.04 ± 0.04 Å³
Cell temperature	99.99 ± 0.17 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	13
Hermann-Mauguin space group symbol	P 1 2/c 1
Hall space group symbol	-P 2yc
Residual factor for all reflections	0.0334
Residual factor for significantly intense reflections	0.0312
Weighted residual factors for significantly intense reflections	0.0847
Weighted residual factors for all reflections included in the refinement	0.0859
Goodness-of-fit parameter for all reflections included in the refinement	1.117
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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