Crystallography Open Database

Information card for entry 7048424

Preview

Coordinates	7048424.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C34 H48 B2 O4
Calculated formula	C34 H48 B2 O4
Title of publication	Simultaneous expansion of 9,10 boron-doped anthracene in longitudinal and lateral directions.
Authors of publication	John, Alexandra; Kirschner, Sven; Fengel, Melina K.; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2019
Journal volume	48
Journal issue	5
Pages of publication	1871 - 1877
a	11.3684 ± 0.0004 Å
b	13.4509 ± 0.0005 Å
c	21.2477 ± 0.0008 Å
α	90°
β	90°
γ	90°
Cell volume	3249.1 ± 0.2 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	4
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for all reflections	0.0409
Residual factor for significantly intense reflections	0.0381
Weighted residual factors for significantly intense reflections	0.0947
Weighted residual factors for all reflections included in the refinement	0.0964
Goodness-of-fit parameter for all reflections included in the refinement	1.044
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
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/7048424.html