Crystallography Open Database

Information card for entry 7235436

Preview

Coordinates	7235436.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C21 H21 Cl2 Hg N3 O3
Calculated formula	C21 H21 Cl2 Hg N3 O3
Title of publication	A water-soluble highly sensitive and selective fluorescent sensor for Hg2+ based on 2-(2-(8-hydroxyquinolin)-yl)benzimidazole via ligand-to-metal charge transfer (LMCT)
Authors of publication	Zhong, Keli; Zhou, Xue; Hou, Ruibin; Zhou, Pei; Hou, Shuhua; Bian, Yanjiang; Zhang, Gang; Tang, Lijun; Shang, Xiaohong
Journal of publication	RSC Advances
Year of publication	2014
Journal volume	4
Journal issue	32
Pages of publication	16612
a	9.9298 ± 0.0004 Å
b	11.196 ± 0.0005 Å
c	12.2592 ± 0.0005 Å
α	90.62 ± 0.001°
β	92.718 ± 0.001°
γ	105.508 ± 0.001°
Cell volume	1311.42 ± 0.1 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0285
Residual factor for significantly intense reflections	0.0263
Weighted residual factors for significantly intense reflections	0.0712
Weighted residual factors for all reflections included in the refinement	0.0731
Goodness-of-fit parameter for all reflections included in the refinement	1.008
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
233031 (current)	2019-11-23	cif/ Adding structures of 7235436, 7235437 via cif-deposit CGI script.	7235436.cif