Crystallography Open Database

Information card for entry 7224604

Preview

Coordinates	7224604.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C37 H23 N3 Ni2 O15 Si
Calculated formula	C37 H23 N3 Ni2 O15.296 Si
Title of publication	Assemblies of metal‒organic frameworks based on a tetrapodal linker for luminescence sensing of tetrahydrofuran
Authors of publication	Gao, Chao-Ying; Wang, Dan; Li, Jian-Ping; Wang, Yuan; Yang, Weiting
Journal of publication	CrystEngComm
Year of publication	2016
Journal volume	18
Journal issue	16
Pages of publication	2857
a	16.1582 ± 0.0011 Å
b	15.99 ± 0.001 Å
c	16.2334 ± 0.001 Å
α	90°
β	90.681 ± 0.002°
γ	90°
Cell volume	4193.9 ± 0.5 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0679
Residual factor for significantly intense reflections	0.0524
Weighted residual factors for significantly intense reflections	0.1604
Weighted residual factors for all reflections included in the refinement	0.175
Goodness-of-fit parameter for all reflections included in the refinement	0.955
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
182648 (current)	2016-05-06	cif/ Updating files of 7224603, 7224604, 7224605, 7224606, 7224607 Original log message: Adding full bibliography for 7224603--7224607.cif.	7224604.cif
178286	2016-03-18	cif/ Adding structures of 7224603, 7224604, 7224605, 7224606, 7224607 via cif-deposit CGI script.	7224604.cif