Crystallography Open Database

Information card for entry 7710780

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Coordinates	7710780.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	2
Formula	C158 H150 B2 Br4 N4 P8 W2
Calculated formula	C158 H150 B2 Br4 N4 P8 W2
Title of publication	Spontaneous N<sub>2</sub>-diboranylation of [W(N<sub>2</sub>)<sub>2</sub>(dppe)<sub>2</sub>] with B<sub>2</sub>Br<sub>4</sub>(SMe<sub>2</sub>)<sub>2</sub>.
Authors of publication	Haufe, Lisa C.; Arrowsmith, Merle; Dietz, Maximilian; Gärtner, Annalena; Bertermann, Rüdiger; Braunschweig, Holger
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2022
a	14.76174 ± 0.00009 Å
b	16.09125 ± 0.0001 Å
c	16.44031 ± 0.00012 Å
α	63.3289 ± 0.0007°
β	82.3742 ± 0.0006°
γ	80.1777 ± 0.0005°
Cell volume	3431.48 ± 0.04 Å³
Cell temperature	99.99 ± 0.1 K
Ambient diffraction temperature	99.99 ± 0.1 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0271
Residual factor for significantly intense reflections	0.0254
Weighted residual factors for significantly intense reflections	0.065
Weighted residual factors for all reflections included in the refinement	0.0659
Goodness-of-fit parameter for all reflections included in the refinement	1.065
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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