Crystallography Open Database

Information card for entry 4101491

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Coordinates	4101491.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C45 H72 Lu N3 Si2
Calculated formula	C45 H63 Lu N3 Si2
Title of publication	Dearomatization and functionalization of terpyridine by lutetium(III) alkyl complexes.
Authors of publication	Jantunen, Kimberly C; Scott, Brian L; Hay, P Jeffrey; Gordon, John C; Kiplinger, Jaqueline L
Journal of publication	Journal of the American Chemical Society
Year of publication	2006
Journal volume	128
Journal issue	19
Pages of publication	6322 - 6323
a	10.7538 ± 0.0014 Å
b	11.8122 ± 0.0016 Å
c	20.525 ± 0.003 Å
α	98.937 ± 0.002°
β	92.135 ± 0.003°
γ	113.937 ± 0.002°
Cell volume	2339.4 ± 0.5 Å³
Cell temperature	203 ± 2 K
Ambient diffraction temperature	203 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.077
Residual factor for significantly intense reflections	0.0438
Weighted residual factors for significantly intense reflections	0.0779
Weighted residual factors for all reflections included in the refinement	0.0857
Goodness-of-fit parameter for all reflections included in the refinement	0.974
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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