Crystallography Open Database

Information card for entry 1542315

Preview

Coordinates	1542315.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C32 H30 N4 O6
Calculated formula	C32 H30 N4 O6
SMILES	C(/c1cc(c(c(c1)OC)O)OC)=N\N=C(/C(c1ccccc1)=N\N=C\c1cc(c(c(c1)OC)O)OC)c1ccccc1
Title of publication	A highly sensitive reversible fluorescent-colorimetric azino bis-Schiff base sensor for rapid detection of Pb2+in aqueous media
Authors of publication	Ghorai, Anupam; Mondal, Jahangir; Saha, Rajat; Bhattacharya, Sumantra; Patra, Goutam K.
Journal of publication	Anal. Methods
Year of publication	2016
Journal volume	8
Journal issue	9
Pages of publication	2032
a	11.84 ± 0.005 Å
b	10.52 ± 0.005 Å
c	23.1 ± 0.005 Å
α	90 ± 0.005°
β	96.951 ± 0.005°
γ	90 ± 0.005°
Cell volume	2856.1 ± 1.9 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.1756
Residual factor for significantly intense reflections	0.0963
Weighted residual factors for significantly intense reflections	0.2211
Weighted residual factors for all reflections included in the refinement	0.286
Goodness-of-fit parameter for all reflections included in the refinement	1.088
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
177623 (current)	2016-03-05	cif/ Updating files of 1542315 Original log message: Adding full bibliography for 1542315.cif.	1542315.cif
175042	2016-01-26	cif/ Adding structures of 1542315 via cif-deposit CGI script.	1542315.cif