Crystallography Open Database

Information card for entry 1572884

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Coordinates	1572884.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C43 H34 Cl2 N2
Calculated formula	C43 H34 Cl2 N2
Title of publication	Hot Exciton Organic Glassy Scintillator for High-Resolution X-ray Imaging
Authors of publication	Yang, Xi; Chen, Jing-Ru; Zhang, Yang; Di, Yi-Ming; Zhang, Guozhen; Chen, Songhua; Chen, Hong-Ming; Lin, Mei-Jin
Journal of publication	Chemical Science
Year of publication	2024
a	7.876 ± 0.008 Å
b	10.166 ± 0.005 Å
c	21.176 ± 0.013 Å
α	78.16 ± 0.05°
β	85.41 ± 0.05°
γ	86.98 ± 0.05°
Cell volume	1653 ± 2 Å³
Cell temperature	296.15 K
Ambient diffraction temperature	296.15 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	0.1097
Residual factor for significantly intense reflections	0.0844
Weighted residual factors for significantly intense reflections	0.2186
Weighted residual factors for all reflections included in the refinement	0.2533
Goodness-of-fit parameter for all reflections included in the refinement	1.055
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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