Crystallography Open Database

Information card for entry 4065161

Preview

Coordinates	4065161.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C111 H245 Ar3 I3 N9 Si9 W3
Calculated formula	C111 H245 Ar3 I3 N9 Si9 W3
Title of publication	Reactivity Studies of (tBu3SiNH)(tBu3SiN═)2WH Including Anionic Derivatives Featuring the Tris-tri-tert-butylsilylimide Tungsten Core
Authors of publication	Schafer, Daniel F.; Wolczanski, Peter T.; Lobkovsky, Emil B.
Journal of publication	Organometallics
Year of publication	2011
Journal volume	30
Journal issue	24
Pages of publication	6539
a	19.065 ± 0.004 Å
b	20.937 ± 0.004 Å
c	23.744 ± 0.005 Å
α	67.569 ± 0.005°
β	66.668 ± 0.007°
γ	63.299 ± 0.006°
Cell volume	7531 ± 3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 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	0.1771
Residual factor for significantly intense reflections	0.1055
Weighted residual factors for all reflections	0.2705
Weighted residual factors for significantly intense reflections	0.2398
Goodness-of-fit parameter for all reflections	1.088
Goodness-of-fit parameter for significantly intense reflections	1.418
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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