Crystallography Open Database

Information card for entry 7715771

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Coordinates	7715771.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C81 H25 B4 F40
Calculated formula	C81 H25 B4 F40
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	12.7646 ± 0.0009 Å
b	16.0907 ± 0.001 Å
c	19.4943 ± 0.0013 Å
α	80.332 ± 0.005°
β	71.304 ± 0.006°
γ	69.47 ± 0.006°
Cell volume	3544.8 ± 0.4 Å³
Cell temperature	100 ± 0.1 K
Ambient diffraction temperature	100 ± 0.1 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0807
Residual factor for significantly intense reflections	0.0592
Weighted residual factors for significantly intense reflections	0.1479
Weighted residual factors for all reflections included in the refinement	0.1563
Goodness-of-fit parameter for all reflections included in the refinement	0.944
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

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