Crystallography Open Database

Information card for entry 7238038

Preview

Coordinates	7238038.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C43 H26 N4 O
Calculated formula	C43 H26 N4 O
Title of publication	Photoluminescent manipulation of phenoxazine-based molecules via regulating conformational isomerization, and the corresponding electroluminescent properties
Authors of publication	Cheng, Zong; Liang, Jixiong; Li, Zhiqiang; Yang, Tong; Lin, Chunhui; Mu, Xiaoyue; Wang, Yue
Journal of publication	Journal of Materials Chemistry C
Year of publication	2019
Journal volume	7
Journal issue	45
Pages of publication	14255
a	13.295 ± 0.0007 Å
b	16.9126 ± 0.001 Å
c	33.4253 ± 0.0019 Å
α	94.049 ± 0.002°
β	96.201 ± 0.002°
γ	90.124 ± 0.002°
Cell volume	7452.8 ± 0.7 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 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	0.0987
Residual factor for significantly intense reflections	0.0596
Weighted residual factors for significantly intense reflections	0.1446
Weighted residual factors for all reflections included in the refinement	0.1577
Goodness-of-fit parameter for all reflections included in the refinement	1.065
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
238878 (current)	2019-11-24	cif/ Adding structures of 7238038, 7238039 via cif-deposit CGI script.	7238038.cif