Crystallography Open Database

Information card for entry 1514926

Preview

Coordinates	1514926.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H15 N O2
Calculated formula	C24 H15 N O2
SMILES	c1(c2ccccc2cc2ccccc12)/C=N/c1cc2ccc(=O)oc2cc1
Title of publication	Anthracene appended coumarin derivative as a Cr(iii) selective turn-on fluorescent probe for living cell imaging: a green approach towards speciation studies
Authors of publication	Guha, Subarna; Lohar, Sisir; Banerjee, Arnab; Sahana, Animesh; Mukhopadhyay, Subhra Kanti; Matalobos, Jesús Sanmartín; Das, Debasis
Journal of publication	Analytical Methods
Year of publication	2012
Journal volume	4
Journal issue	10
Pages of publication	3163
a	6.661 Å
b	30.083 Å
c	17.635 Å
α	90°
β	99.52°
γ	90°
Cell volume	3485.08 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/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.1417
Residual factor for significantly intense reflections	0.0628
Weighted residual factors for significantly intense reflections	0.1258
Weighted residual factors for all reflections included in the refinement	0.1599
Goodness-of-fit parameter for all reflections included in the refinement	1.034
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
176729 (current)	2016-02-18	cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 1.	1514926.cif
129076	2014-12-26	Fixing formulae and Z values for several entries	1514926.cif
110788	2014-04-20	cif/ Adding structures of 1514926 via cif-deposit CGI script.	1514926.cif