Crystallography Open Database

Information card for entry 4113017

Preview

Structure parameters

Formula	C26 H17 N3 O4
Calculated formula	C26 H17 N3 O4
SMILES	O=C1N(c2ccc(N(c3ccc(N4C(=O)C=CC4=O)cc3)c3ccccc3)cc2)C(=O)C=C1
Title of publication	Multi-Maleimides Bearing Electron-Donating Chromophores: Reversible Fluorescence and Aggregation Behavior
Authors of publication	Xin Zhang; Zi-Chen Li; Kai-Bo Li; Fu-Sheng Du; Fu-Mian Li
Journal of publication	Journal of the American Chemical Society
Year of publication	2004
Journal volume	126
Pages of publication	12200 - 12201
a	9.7993 ± 0.0002 Å
b	11.1782 ± 0.0002 Å
c	11.544 ± 0.0003 Å
α	65.8541 ± 0.0009°
β	66.0412 ± 0.0009°
γ	84.3268 ± 0.0009°
Cell volume	1051.02 ± 0.04 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0879
Residual factor for significantly intense reflections	0.0418
Weighted residual factors for significantly intense reflections	0.1
Weighted residual factors for all reflections included in the refinement	0.1111
Goodness-of-fit parameter for all reflections included in the refinement	0.985
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4113017.html