Crystallography Open Database

Information card for entry 7156648

Preview

Coordinates	7156648.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H35 N10 O6.5
Calculated formula	C36 H35 N10 O6.5
Title of publication	Glycosylated naphthalimides and naphthalimide Tröger's bases as fluorescent aggregation probes for Con A.
Authors of publication	Calatrava-Pérez, Elena; Delente, Jason M.; Shanmugaraju, Sankarasekaran; Hawes, Chris S.; Williams, Clive D.; Gunnlaugsson, Thorfinnur; Scanlan, Eoin M.
Journal of publication	Organic & biomolecular chemistry
Year of publication	2019
Journal volume	17
Journal issue	8
Pages of publication	2116 - 2125
a	17.0714 ± 0.0012 Å
b	27.849 ± 0.002 Å
c	6.8249 ± 0.0003 Å
α	90°
β	90°
γ	90°
Cell volume	3244.7 ± 0.4 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 K
Number of distinct elements	4
Space group number	18
Hermann-Mauguin space group symbol	P 21 21 2
Hall space group symbol	P 2 2ab
Residual factor for all reflections	0.0924
Residual factor for significantly intense reflections	0.0754
Weighted residual factors for significantly intense reflections	0.1873
Weighted residual factors for all reflections included in the refinement	0.2039
Goodness-of-fit parameter for all reflections included in the refinement	1.082
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
225091 (current)	2019-11-08	cif/ Updating files of 7156648 Original log message: Adding full bibliography for 7156648.cif.	7156648.cif
212999	2019-01-11	cif/ Adding structures of 7156648 via cif-deposit CGI script.	7156648.cif