Crystallography Open Database

Information card for entry 7135562

Preview

Coordinates	7135562.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C56 H78 Br4 O2 P4
Calculated formula	C54 H70 Br4 P4
Title of publication	Tetracationic phosphonium-bridged ladder stilbenes: Redox states and electronic properties of highly charged P-heteropolycyclic materials
Authors of publication	Senn, Sebastian; Konrad, Nele; Müller, Jens; Ballmann, Joachim; Gade, Lutz H.
Journal of publication	Chemical Communications
Year of publication	2026
a	23.0439 ± 0.0003 Å
b	8.5972 ± 0.0001 Å
c	30.0718 ± 0.0004 Å
α	90°
β	102.595 ± 0.001°
γ	90°
Cell volume	5814.25 ± 0.13 Å³
Cell temperature	120 ± 1 K
Ambient diffraction temperature	120 ± 1 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0571
Residual factor for significantly intense reflections	0.0531
Weighted residual factors for significantly intense reflections	0.1541
Weighted residual factors for all reflections included in the refinement	0.1592
Goodness-of-fit parameter for all reflections included in the refinement	1.072
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
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/7135562.html