Crystallography Open Database

Information card for entry 7715582

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Coordinates	7715582.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C34 H58 B P Si3
Calculated formula	C34 H58 B P Si3
Title of publication	Frustrated Lewis pair adducts of alkynyl-capped tetrelenes.
Authors of publication	Muralidharan, Abhishek V.; Frenette, Brandon L.; Wicke, Julius; Omaña, Alvaro A; Ferguson, Michael J.; Rivard, Eric
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2024
Journal volume	53
Journal issue	16
Pages of publication	7206 - 7212
a	11.7526 ± 0.0012 Å
b	19.307 ± 0.002 Å
c	16.8909 ± 0.0017 Å
α	90°
β	105.096 ± 0.0017°
γ	90°
Cell volume	3700.4 ± 0.7 Å³
Cell temperature	193.15 K
Ambient diffraction temperature	193.15 K
Number of distinct elements	5
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	0.0556
Residual factor for significantly intense reflections	0.0433
Weighted residual factors for significantly intense reflections	0.1149
Weighted residual factors for all reflections included in the refinement	0.126
Goodness-of-fit parameter for all reflections included in the refinement	1.037
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
291638 (current)	2024-05-05	cif/ Updating files of 7715580, 7715581, 7715582 Original log message: Adding full bibliography for 7715580--7715582.cif.	7715582.cif
290722	2024-04-02	cif/ Adding structures of 7715580, 7715581, 7715582 via cif-deposit CGI script.	7715582.cif