Crystallography Open Database

Information card for entry 4070968

Preview

Coordinates	4070968.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C89 H85 Lu N2 O3
Calculated formula	C75 H69 Lu N2 O3
Title of publication	Synthesis, Characterization, and Reactivity of the Thermally Stable Lutetium Tris(alkyl) Complex (tBu2bpy)Lu(CH2SiMe3)3
Authors of publication	Masuda, Jason D.; Jantunen, Kimberly C.; Scott, Brian L.; Kiplinger, Jaqueline L.
Journal of publication	Organometallics
Year of publication	2008
Journal volume	27
Journal issue	6
Pages of publication	1299
a	13.3606 ± 0.0006 Å
b	13.8467 ± 0.0007 Å
c	19.4716 ± 0.0009 Å
α	92.117 ± 0.001°
β	98.748 ± 0.001°
γ	96.669 ± 0.001°
Cell volume	3530.8 ± 0.3 Å³
Cell temperature	141 ± 2 K
Ambient diffraction temperature	141 ± 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	0.052
Residual factor for significantly intense reflections	0.043
Weighted residual factors for significantly intense reflections	0.1069
Weighted residual factors for all reflections included in the refinement	0.1114
Goodness-of-fit parameter for all reflections included in the refinement	1.144
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
178598 (current)	2016-03-21	cif/4/07/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/07/09.	4070968.cif
120075	2014-07-11	Adding DOIs to range 4/07 structures.	4070968.cif
47256	2012-03-23	cif/4/ Distributing the new range 4 CIFs into their appropriate prefixed subdirectories.	4070968.cif
42922	2012-03-13	../uploads/cif-deposit/cod/cif Adding structures of 4070966, 4070967, 4070968, 4070969, 4070970 via cif-deposit CGI script.	4070968.cif