Crystallography Open Database

Information card for entry 7715772

Preview

Coordinates	7715772.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C40 H40 B2 N2
Calculated formula	C40 H40 B2 N2
Title of publication	Bidentate Boron Lewis Acids: Synthesis by Tin Boron Exchange Reaction and Host-Guest Complex Formation
Authors of publication	Beckmann, Jean Louis; Neumann, Beate; Stammler, Georg; Lamm, Jan-Hendrik; Mitzel, Norbert Werner
Journal of publication	Dalton Transactions
Year of publication	2024
a	10.3734 ± 0.0003 Å
b	19.5963 ± 0.0005 Å
c	15.8553 ± 0.0003 Å
α	90°
β	102.198 ± 0.002°
γ	90°
Cell volume	3150.3 ± 0.14 Å³
Cell temperature	100 ± 0.1 K
Ambient diffraction temperature	100 ± 0.1 K
Number of distinct elements	4
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.058
Residual factor for significantly intense reflections	0.0402
Weighted residual factors for significantly intense reflections	0.0946
Weighted residual factors for all reflections included in the refinement	0.1048
Goodness-of-fit parameter for all reflections included in the refinement	1.013
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

Version history

Revision	Date	Message	Files
291268 (current)	2024-04-18	cif/ Adding structures of 7715770, 7715771, 7715772, 7715773, 7715774, 7715775, 7715776, 7715777, 7715778, 7715779, 7715780, 7715781 via cif-deposit CGI script.	7715772.cif