Crystallography Open Database

Information card for entry 7246614

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Coordinates	7246614.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C54 H32 N4 O16 Zn4
Calculated formula	C54 H32 N4 O16 Zn4
Title of publication	Four Zn(ii)-5-(2-carboxy-phenoxy)-1,3-benzenedicarboxylate coordination polymers induced by different N-ligands: synthesis, structure, and fluorescence detection for BPA and IMH
Authors of publication	Zhang, Kena; Wang, Qiushuang; Gong, Yuanyuan; Wang, Nairong; Li, Xia
Journal of publication	CrystEngComm
Year of publication	2023
Journal volume	25
Journal issue	20
Pages of publication	3033 - 3043
a	21.1334 ± 0.0008 Å
b	10.3316 ± 0.0004 Å
c	26.5739 ± 0.0008 Å
α	90°
β	121.011 ± 0.002°
γ	90°
Cell volume	4972.9 ± 0.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0537
Residual factor for significantly intense reflections	0.042
Weighted residual factors for significantly intense reflections	0.1058
Weighted residual factors for all reflections included in the refinement	0.1125
Goodness-of-fit parameter for all reflections included in the refinement	1.023
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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