Crystallography Open Database

Information card for entry 7020147

7020146 << 7020147 >> 7020148

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Coordinates	7020147.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C46 H42 N3 O16 Zn2
Calculated formula	C46 H26 N3 O16 Zn2
Title of publication	Post-modification of a MOF through a fluorescent-labeling technology for the selective sensing and adsorption of Ag+ in aqueous solution.
Authors of publication	Zhang, Lejie; Jian, Yuan; Wang, Jian; He, Cheng; Li, Xuezhao; Liu, Tao; Duan, Chunying
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2012
Journal volume	41
Journal issue	34
Pages of publication	10153 - 10155
a	27.6571 ± 0.0016 Å
b	27.6571 ± 0.0016 Å
c	27.6571 ± 0.0016 Å
α	90°
β	90°
γ	90°
Cell volume	21155 ± 2 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 ± 2 K
Number of distinct elements	5
Space group number	218
Hermann-Mauguin space group symbol	P -4 3 n
Hall space group symbol	P -4n 2 3
Residual factor for all reflections	0.1616
Residual factor for significantly intense reflections	0.0617
Weighted residual factors for significantly intense reflections	0.0981
Weighted residual factors for all reflections included in the refinement	0.1157
Goodness-of-fit parameter for all reflections included in the refinement	1.002
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
179905 (current)	2016-03-25	cif/7/02/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/02/01.	7020147.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7020147.cif
71513	2013-01-20	cif/ Adding structures of 7020147 via cif-deposit CGI script.	7020147.cif