Crystallography Open Database

Information card for entry 7237362

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Coordinates	7237362.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H14 N4 O S
Calculated formula	C20 H14 N4 O S
Title of publication	Expression of anti-Kasha's emission from amino benzothiadiazole and its utilization for fluorescent chemosensors and organic light emitting materials
Authors of publication	Peng, Zhixing; Wang, Zaibin; Huang, Zongwei; Liu, Shaojie; Lu, Ping; Wang, Yanguang
Journal of publication	Journal of Materials Chemistry C
Year of publication	2018
Journal volume	6
Journal issue	29
Pages of publication	7864
a	9.1703 ± 0.0008 Å
b	19.85 ± 0.003 Å
c	18.7033 ± 0.0018 Å
α	90°
β	102.929 ± 0.009°
γ	90°
Cell volume	3318.3 ± 0.7 Å³
Cell temperature	170 K
Ambient diffraction temperature	170 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0742
Residual factor for significantly intense reflections	0.049
Weighted residual factors for significantly intense reflections	0.1139
Weighted residual factors for all reflections included in the refinement	0.1339
Goodness-of-fit parameter for all reflections included in the refinement	1.028
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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