Crystallography Open Database

Information card for entry 7227000

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Coordinates	7227000.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C51 H47 O21 P3 Pb3
Calculated formula	C51 H48 O21 P3 Pb3
Title of publication	Two fluorescent lead phosphonates for highly selective sensing of nitro aromatics (NACs), Fe3+ and MnO4− ions
Authors of publication	Xing, Bo; Li, Huan-Yu; Zhu, Yanyu; Zhao, Zhou; Sun, Zhen-Gang; Yang, Dan; Li, Jing
Journal of publication	RSC Adv.
Year of publication	2016
a	12.142 ± 0.0005 Å
b	15.4695 ± 0.0006 Å
c	15.6819 ± 0.0006 Å
α	96.676 ± 0.001°
β	94.121 ± 0.001°
γ	111.124 ± 0.001°
Cell volume	2708.33 ± 0.19 Å³
Cell temperature	295 ± 2 K
Ambient diffraction temperature	295.15 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0565
Residual factor for significantly intense reflections	0.0358
Weighted residual factors for significantly intense reflections	0.0756
Weighted residual factors for all reflections included in the refinement	0.083
Goodness-of-fit parameter for all reflections included in the refinement	1.014
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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