Crystallography Open Database

Information card for entry 4103743

Preview

Coordinates	4103743.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C25 H24 B4 O8
Calculated formula	C25 H24 B4 O8
Title of publication	Molecular Tectonics. Use of the Hydrogen Bonding of Boronic Acids To Direct Supramolecular Construction
Authors of publication	Jean-Hugues Fournier; Thierry Maris; James D. Wuest; Wenzhuo Guo; Elena Galoppini
Journal of publication	Journal of the American Chemical Society
Year of publication	2003
Journal volume	125
Pages of publication	1002 - 1006
a	10.627 ± 0.011 Å
b	10.627 ± 0.011 Å
c	41.608 ± 0.006 Å
α	90°
β	90°
γ	90°
Cell volume	4699 ± 7 Å³
Cell temperature	226 K
Ambient diffraction temperature	226 K
Number of distinct elements	4
Space group number	88
Hermann-Mauguin space group symbol	I 41/a :2
Hall space group symbol	-I 4ad
Residual factor for all reflections	0.3307
Residual factor for significantly intense reflections	0.0978
Weighted residual factors for significantly intense reflections	0.141
Weighted residual factors for all reflections included in the refinement	0.1594
Goodness-of-fit parameter for all reflections included in the refinement	0.981
Diffraction radiation wavelength	1.54178 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/4103743.html