Crystallography Open Database

Information card for entry 7126938

Preview

Coordinates	7126938.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H20 F6 S2 Sn
Calculated formula	C28 H20 F6 S2 Sn
Title of publication	Aggregation induced emission - emissive stannoles in the solid state.
Authors of publication	Ramirez Y Medina, Isabel-Maria; Rohdenburg, Markus; Lork, Enno; Staubitz, Anne
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2020
Journal volume	56
Journal issue	68
Pages of publication	9775 - 9778
a	11.5212 ± 0.0004 Å
b	12.1354 ± 0.0005 Å
c	9.7135 ± 0.0003 Å
α	90°
β	104.176 ± 0.001°
γ	90°
Cell volume	1316.73 ± 0.08 Å³
Cell temperature	100 K
Ambient diffraction temperature	100 K
Number of distinct elements	5
Space group number	13
Hermann-Mauguin space group symbol	P 1 2/c 1
Hall space group symbol	-P 2yc
Residual factor for all reflections	0.0305
Residual factor for significantly intense reflections	0.0244
Weighted residual factors for significantly intense reflections	0.0496
Weighted residual factors for all reflections included in the refinement	0.0517
Goodness-of-fit parameter for all reflections included in the refinement	1.083
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
256015 (current)	2020-09-06	cif/ Updating files of 7126937, 7126938, 7126939, 7126940 Original log message: Adding full bibliography for 7126937--7126940.cif.	7126938.cif
254413	2020-07-21	cif/ Adding structures of 7126937, 7126938, 7126939, 7126940 via cif-deposit CGI script.	7126938.cif