Crystallography Open Database

Information card for entry 7237358

Preview

Coordinates	7237358.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C17 H19 N3 O S
Calculated formula	C17 H19 N3 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	8.4386 ± 0.0008 Å
b	9.4891 ± 0.0009 Å
c	11.2415 ± 0.0011 Å
α	106.972 ± 0.009°
β	102.465 ± 0.008°
γ	107.518 ± 0.008°
Cell volume	774.17 ± 0.16 Å³
Cell temperature	170 K
Ambient diffraction temperature	170 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0706
Residual factor for significantly intense reflections	0.0499
Weighted residual factors for significantly intense reflections	0.1115
Weighted residual factors for all reflections included in the refinement	0.1282
Goodness-of-fit parameter for all reflections included in the refinement	1.056
Diffraction radiation wavelength	0.7107 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/7237358.html