Crystallography Open Database

Information card for entry 4071391

Preview

Coordinates	4071391.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C32 H50 N2 Ti
Calculated formula	C32 H50 N2 Ti
Title of publication	Formation of a Titanium Complex with a TiCHAl2Structural Unit from LTiMe3and Trimethylaluminum§
Authors of publication	Nikiforov, Grigory B.; Roesky, Herbert W.; Heisen, Burkhard C.; Oswald, Rainer B.
Journal of publication	Organometallics
Year of publication	2008
Journal volume	27
Journal issue	11
Pages of publication	2544
a	14.245 ± 0.003 Å
b	22.068 ± 0.004 Å
c	10.071 ± 0.002 Å
α	90°
β	90°
γ	90°
Cell volume	3165.9 ± 1.1 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	4
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	0.0602
Residual factor for significantly intense reflections	0.0448
Weighted residual factors for significantly intense reflections	0.1001
Weighted residual factors for all reflections included in the refinement	0.1078
Goodness-of-fit parameter for all reflections included in the refinement	1.059
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
178602 (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 4/07/13.	4071391.cif
120075	2014-07-11	Adding DOIs to range 4/07 structures.	4071391.cif
47256	2012-03-23	cif/4/ Distributing the new range 4 CIFs into their appropriate prefixed subdirectories.	4071391.cif
43179	2012-03-13	../uploads/cif-deposit/cod/cif Adding structures of 4071391 via cif-deposit CGI script.	4071391.cif