Crystallography Open Database

Information card for entry 7715781

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Coordinates	7715781.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H38 B2 N2
Calculated formula	C36 H38 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	11.8924 ± 0.0003 Å
b	16.8358 ± 0.0003 Å
c	16.0803 ± 0.0003 Å
α	90°
β	110.959 ± 0.002°
γ	90°
Cell volume	3006.55 ± 0.12 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/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0545
Residual factor for significantly intense reflections	0.0347
Weighted residual factors for significantly intense reflections	0.068
Weighted residual factors for all reflections included in the refinement	0.0751
Goodness-of-fit parameter for all reflections included in the refinement	1.0827
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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