Crystallography Open Database

Information card for entry 7003525

Preview

Coordinates	7003525.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	(O(SiMeNCPhCHCPhNLi(thf)2)2).(thf)
Formula	C52 H68 Li2 N4 O6 Si2
Calculated formula	C52 H68 Li2 N4 O6 Si2
Title of publication	Synthesis and structures of some new types of lithium β-diketiminates
Authors of publication	Wei, Xue-Hong; Farwell, James D.; Hitchcock, Peter B.; Lappert, Michael F.
Journal of publication	Dalton Transactions
Year of publication	2008
Journal issue	8
Pages of publication	1073 - 1080
a	20.4546 ± 0.0005 Å
b	14.9128 ± 0.0004 Å
c	17.1049 ± 0.0005 Å
α	90°
β	90°
γ	90°
Cell volume	5217.6 ± 0.2 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	6
Space group number	62
Hermann-Mauguin space group symbol	P n m a
Hall space group symbol	-P 2ac 2n
Residual factor for all reflections	0.0849
Residual factor for significantly intense reflections	0.0605
Weighted residual factors for significantly intense reflections	0.1611
Weighted residual factors for all reflections included in the refinement	0.179
Goodness-of-fit parameter for all reflections included in the refinement	1.039
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
179739 (current)	2016-03-25	cif/7/00/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/00/35.	7003525.cif
120443	2014-07-15	Adding 17924 DOIs guessed from source file names.	7003525.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7003525.cif
1173	2010-05-16	cif/7/: adding data from Dalton-Trans-2008, New-J-Chem-2008, Org-Biomol-Chem-2008 and RSC-2008 processing.	7003525.cif