Crystallography Open Database

Information card for entry 7103552

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Coordinates	7103552.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48 H38 N4
Calculated formula	C48 H38 N4
Title of publication	Torsionally restricted tetradentate fluorophore: a swivelling ligand platform for ratiometric sensing of metal ions.
Authors of publication	Jiang, Xuan; Gyu Park, Byung; Riddle, Justin A; June Zhang, Bong; Pink, Maren; Lee, Dongwhan
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2008
Journal issue	45
Pages of publication	6028 - 6030
a	19.8857 ± 0.0013 Å
b	6.7009 ± 0.0004 Å
c	27.6711 ± 0.0018 Å
α	90°
β	90°
γ	90°
Cell volume	3687.2 ± 0.4 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	3
Space group number	29
Hermann-Mauguin space group symbol	P c a 21
Hall space group symbol	P 2c -2ac
Residual factor for all reflections	0.0602
Residual factor for significantly intense reflections	0.0515
Weighted residual factors for significantly intense reflections	0.1336
Weighted residual factors for all reflections included in the refinement	0.1391
Goodness-of-fit parameter for all reflections included in the refinement	1.056
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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