Crystallography Open Database

Information card for entry 7134323

Preview

Coordinates	7134323.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H24 F6 Si2
Calculated formula	C28 H24 F6 Si2
Title of publication	1,5-Disila-<i>s</i>-indacene-based emitters: a molecular design towards efficient blue OLEDs.
Authors of publication	Feng, Jianbin; Samedov, Kerim; Lu, Yanfei; Chen, Dongcheng; Cai, Yuanjing
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2025
Journal volume	61
Journal issue	29
Pages of publication	5491 - 5494
a	8.6747 ± 0.0005 Å
b	15.1646 ± 0.001 Å
c	10.2043 ± 0.0006 Å
α	90°
β	103.579 ± 0.005°
γ	90°
Cell volume	1304.84 ± 0.14 Å³
Cell temperature	114.55 ± 0.1 K
Ambient diffraction temperature	114.55 ± 0.1 K
Number of distinct elements	4
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	0.0741
Residual factor for significantly intense reflections	0.0518
Weighted residual factors for significantly intense reflections	0.1095
Weighted residual factors for all reflections included in the refinement	0.1253
Goodness-of-fit parameter for all reflections included in the refinement	1.052
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
298743 (current)	2025-04-05	cif/ Updating files of 7134323, 7134324 Original log message: Adding full bibliography for 7134323--7134324.cif.	7134323.cif
298378	2025-03-12	cif/ Adding structures of 7134323, 7134324 via cif-deposit CGI script.	7134323.cif