Crystallography Open Database

Information card for entry 7063668

Preview

Coordinates	7063668.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C34 H36 B2 F4 N4
Calculated formula	C34 H36 B2 F4 N4
Title of publication	Organoboron emitters with narrowband thermally activated delayed fluorescence for doped organic light emitting diodes
Authors of publication	Zhao, Tingting; A., Suru; Ma, Yurong; Wang, Nan; Su, Zhongmin; Liu, Fangbin
Journal of publication	New Journal of Chemistry
Year of publication	2025
Journal volume	49
Journal issue	10
Pages of publication	4035 - 4041
a	6.2488 ± 0.0009 Å
b	8.9759 ± 0.0012 Å
c	14.662 ± 0.002 Å
α	72.625 ± 0.005°
β	79.192 ± 0.005°
γ	71.413 ± 0.004°
Cell volume	740.02 ± 0.18 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	0.0865
Residual factor for significantly intense reflections	0.0695
Weighted residual factors for significantly intense reflections	0.1878
Weighted residual factors for all reflections included in the refinement	0.2013
Goodness-of-fit parameter for all reflections included in the refinement	1.092
Diffraction radiation wavelength	1.34139 Å
Diffraction radiation type	GaKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
298986 (current)	2025-04-05	cif/ Updating files of 7063668 Original log message: Adding full bibliography for 7063668.cif.	7063668.cif
297792	2025-02-20	cif/ Adding structures of 7063668 via cif-deposit CGI script.	7063668.cif