Crystallography Open Database

Information card for entry 7219603

7219602 << 7219603 >> 7219604

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Coordinates	7219603.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C21 H23 Cd2 N5 O12
Calculated formula	C21 H23 Cd2 N5 O12
Title of publication	A new Cd(ii)-based metal‒organic framework for highly sensitive fluorescence sensing of nitrobenzene
Authors of publication	Xia, Yu-Pei; Li, Yun-Wu; Li, Da-Cheng; Yao, Qing-Xia; Du, Yu-Chang; Dou, Jian-Min
Journal of publication	CrystEngComm
Year of publication	2015
Journal volume	17
Journal issue	12
Pages of publication	2459
a	23.286 ± 0.002 Å
b	17.2577 ± 0.0016 Å
c	18.2221 ± 0.0017 Å
α	90°
β	126.661 ± 0.003°
γ	90°
Cell volume	5874.2 ± 1 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 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	0.1442
Residual factor for significantly intense reflections	0.0707
Weighted residual factors for significantly intense reflections	0.1428
Weighted residual factors for all reflections included in the refinement	0.1616
Goodness-of-fit parameter for all reflections included in the refinement	1.009
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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