Crystallography Open Database

Information card for entry 7227241

Preview

Coordinates	7227241.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H15 N3 O15 Zn3
Calculated formula	C24 H15 N3 O15 Zn3
Title of publication	Two cage-based zinc-tetracarboxylate frameworks with white-light emission
Authors of publication	Li, Qipeng; Luo, Jiagang; Wang, Lei; Qi, Cen; Yang, Yongsheng; Zhang, Xinjun; Qian, Jinjie
Journal of publication	CrystEngComm
Year of publication	2017
Journal volume	19
Journal issue	2
Pages of publication	214
a	23.0687 ± 0.0014 Å
b	23.0687 ± 0.0014 Å
c	20.7587 ± 0.0017 Å
α	90°
β	90°
γ	120°
Cell volume	9567 ± 1.1 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	5
Space group number	147
Hermann-Mauguin space group symbol	P -3
Hall space group symbol	-P 3
Residual factor for all reflections	0.1378
Residual factor for significantly intense reflections	0.1126
Weighted residual factors for significantly intense reflections	0.2952
Weighted residual factors for all reflections included in the refinement	0.3127
Goodness-of-fit parameter for all reflections included in the refinement	1.007
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
191553 (current)	2017-02-04	cif/ Updating files of 7227241, 7227242 Original log message: Adding full bibliography for 7227241--7227242.cif.	7227241.cif
188999	2016-12-08	cif/ Adding structures of 7227241, 7227242 via cif-deposit CGI script.	7227241.cif