Crystallography Open Database

Information card for entry 7220966

7220965 << 7220966 >> 7220967

Preview

Coordinates	7220966.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C15 H11 N O7 Zn
Calculated formula	C15 H11 N O7 Zn
Title of publication	Construction of a series of metal‒organic frameworks based on novel flexible ligand 4-carboxy-1-(3,5-dicarboxy-benzyl)-pyridinium chloride and selective d-block metal ions: crystal structures and photoluminescence
Authors of publication	Li, Hai-Yang; Cao, Li-Hui; Wei, Yong-Li; Xu, Hong; Zang, Shuang-Quan
Journal of publication	CrystEngComm
Year of publication	2015
Journal volume	17
Journal issue	33
Pages of publication	6297
a	7.4952 ± 0.0002 Å
b	17.417 ± 0.0005 Å
c	21.7353 ± 0.0005 Å
α	90°
β	90°
γ	90°
Cell volume	2837.41 ± 0.13 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.0391
Residual factor for significantly intense reflections	0.0314
Weighted residual factors for significantly intense reflections	0.0715
Weighted residual factors for all reflections included in the refinement	0.0746
Goodness-of-fit parameter for all reflections included in the refinement	1.026
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
171083 (current)	2015-12-09	cif/ Updating files of 7220965, 7220966, 7220967, 7220968, 7220969, 7220970, 7220971 Original log message: Adding full bibliography for 7220965--7220971.cif.	7220966.cif
139896	2015-07-02	cif/ Adding structures of 7220965, 7220966, 7220967, 7220968, 7220969, 7220970, 7220971 via cif-deposit CGI script.	7220966.cif