Crystallography Open Database

Information card for entry 7220551

7220550 << 7220551 >> 7220552

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Coordinates	7220551.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H44 Cd N4 O16
Calculated formula	C24 H43 Cd N4 O16
Title of publication	One-dimensional water cages with repeat units of (H2O)24resembling pagodane trapped in a 3D coordination polymer: proton conduction and tunable luminescence emission by adsorption of anionic dyes
Authors of publication	Maity, Kartik; Kundu, Tanay; Banerjee, Rahul; Biradha, Kumar
Journal of publication	CrystEngComm
Year of publication	2015
Journal volume	17
Journal issue	24
Pages of publication	4439
a	17.679 ± 0.005 Å
b	27.134 ± 0.007 Å
c	6.9113 ± 0.0018 Å
α	90°
β	94.222 ± 0.008°
γ	90°
Cell volume	3306.4 ± 1.5 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	12
Hermann-Mauguin space group symbol	C 1 2/m 1
Hall space group symbol	-C 2y
Residual factor for all reflections	0.0516
Residual factor for significantly intense reflections	0.043
Weighted residual factors for significantly intense reflections	0.1306
Weighted residual factors for all reflections included in the refinement	0.1455
Goodness-of-fit parameter for all reflections included in the refinement	0.916
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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