Crystallography Open Database

Information card for entry 7710300

Preview

Coordinates	7710300.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C25.49 H26.51 N3.5 O15.52 Zn2
Calculated formula	C24 H14.007 N3 O11.0136 Zn2
Title of publication	Three-pole wheel paddle luminescent metal organic frameworks (LMOFs) based on the oxygen substituted triazine tricarboxylic acid ligand: recognition and detection of small drug molecules and aromatic amine molecules.
Authors of publication	Xiao, Yao; You, Zi Xin; Xing, Yong Heng; Bai, Feng Ying; Shi, Zhan
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2022
Journal volume	51
Journal issue	24
Pages of publication	9336 - 9347
a	16.8223 ± 0.0018 Å
b	16.8223 ± 0.0018 Å
c	6.8892 ± 0.0014 Å
α	90°
β	90°
γ	120°
Cell volume	1688.4 ± 0.4 Å³
Cell temperature	301.26 K
Ambient diffraction temperature	301.26 K
Number of distinct elements	5
Space group number	176
Hermann-Mauguin space group symbol	P 63/m
Hall space group symbol	-P 6c
Residual factor for all reflections	0.1275
Residual factor for significantly intense reflections	0.074
Weighted residual factors for significantly intense reflections	0.1733
Weighted residual factors for all reflections included in the refinement	0.2067
Goodness-of-fit parameter for all reflections included in the refinement	0.966
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
276613 (current)	2022-07-06	cif/ Updating files of 7710299, 7710300 Original log message: Adding full bibliography for 7710299--7710300.cif.	7710300.cif
275601	2022-05-22	cif/ Adding structures of 7710299, 7710300 via cif-deposit CGI script.	7710300.cif