Crystallography Open Database

Information card for entry 4060417

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Coordinates	4060417.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C41.5 H52 N2 P2 Si2 Y
Calculated formula	C41.5 H47 N2 P2 Si2 Y
Title of publication	Cyclooctatetraene Complexes of Yttrium and the Lanthanides with Bis(phosphinimino)methanides: Synthesis, Structure, and Hydroamination/Cyclization Catalysis
Authors of publication	Panda, Tarun K.; Zulys, Agustino; Gamer, Michael T.; Roesky, Peter W.
Journal of publication	Organometallics
Year of publication	2005
Journal volume	24
Journal issue	9
Pages of publication	2197 - 2202
a	9.4016 ± 0.0017 Å
b	9.5304 ± 0.0016 Å
c	22.771 ± 0.004 Å
α	93.146 ± 0.004°
β	92.938 ± 0.004°
γ	98.53 ± 0.004°
Cell volume	2011.1 ± 0.6 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0465
Residual factor for significantly intense reflections	0.0341
Weighted residual factors for significantly intense reflections	0.0875
Weighted residual factors for all reflections included in the refinement	0.0949
Goodness-of-fit parameter for all reflections included in the refinement	1.064
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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