Crystallography Open Database

Information card for entry 4342952

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Coordinates	4342952.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C57 H76 Cl3 Gd N6 O15
Calculated formula	C57 H60 Cl3 Gd N6 O15
Title of publication	Linear Dependence of Photoluminescence in Mixed Ln-MOFs for Color Tunability and Barcode Application.
Authors of publication	Yang, Qing-Yuan; Pan, Mei; Wei, Shi-Chao; Li, Kang; Du, Bin-Bin; Su, Cheng-Yong
Journal of publication	Inorganic chemistry
Year of publication	2015
Journal volume	54
Journal issue	12
Pages of publication	5707 - 5716
a	14.3406 ± 0.0002 Å
b	13.8448 ± 0.0002 Å
c	15.6676 ± 0.0002 Å
α	90°
β	90.702 ± 0.001°
γ	90°
Cell volume	3110.45 ± 0.07 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 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	0.0408
Residual factor for significantly intense reflections	0.0402
Weighted residual factors for significantly intense reflections	0.1199
Weighted residual factors for all reflections included in the refinement	0.1211
Goodness-of-fit parameter for all reflections included in the refinement	1.068
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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