Crystallography Open Database

Information card for entry 7719459

7719458 << 7719459 >> 7719460

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Coordinates	7719459.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C29 H21 Ca N12 O16
Calculated formula	C29 H21 Ca N12 O16
Title of publication	Carboxylate ligand-directed synthesis of cucurbit[5]uril-based coordination polymers for the detection of norfloxacin.
Authors of publication	Cao, Jia; Gu, Jia-Yu; Ding, Wen-Ya; Chen, Xin-Ran; Hua, Zi-Yi; Chen, Kai
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2025
Journal volume	54
Journal issue	40
Pages of publication	15197 - 15205
a	16.038 ± 0.005 Å
b	25.832 ± 0.005 Å
c	17.773 ± 0.005 Å
α	90 ± 0.005°
β	101.694 ± 0.005°
γ	90 ± 0.005°
Cell volume	7210 ± 3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0573
Residual factor for significantly intense reflections	0.0485
Weighted residual factors for significantly intense reflections	0.1457
Weighted residual factors for all reflections included in the refinement	0.1522
Goodness-of-fit parameter for all reflections included in the refinement	1.065
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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