Crystallography Open Database

Information card for entry 7007472

Preview

Coordinates	7007472.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C26 H26 F15 Li O4 Ti
Calculated formula	C26 H26 F15 Li O4 Ti
Title of publication	The reaction of TiF4 with Li(OC(CF3)2Ph): direct synthetic route to the lithium-titanium heterometallic fluoride bridged complex {Li(THF)2TiF3(OC(CF3)2Ph)2}2 and Ti(OC(CF3)2Ph)4 alkoxide.
Authors of publication	Decken, Andreas; Nikiforov, Grigori B.; Passmore, Jack
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2006
Journal issue	36
Pages of publication	4328 - 4334
a	11.416 ± 0.0013 Å
b	11.6326 ± 0.0013 Å
c	12.447 ± 0.0015 Å
α	86.285 ± 0.003°
β	73.048 ± 0.003°
γ	70.442 ± 0.002°
Cell volume	1488.9 ± 0.3 Å³
Cell temperature	198 ± 1 K
Ambient diffraction temperature	198 ± 1 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	0.0514
Residual factor for significantly intense reflections	0.0403
Weighted residual factors for significantly intense reflections	0.1131
Weighted residual factors for all reflections included in the refinement	0.12
Goodness-of-fit parameter for all reflections included in the refinement	1.11
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
179778 (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 7/00/74.	7007472.cif
120443	2014-07-15	Adding 17924 DOIs guessed from source file names.	7007472.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7007472.cif
1504	2010-09-08	cif/7/ Adding data extracted from RSC 2005 and 2006 year publications.	7007472.cif