Crystallography Open Database

Information card for entry 7008245

Preview

Coordinates	7008245.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	(K(tmeda)(C11H8N))n
Formula	C17 H24 K N3
Calculated formula	C17 H24 K N3
Title of publication	Structural studies of group 1 metal 4-azapentalenyl complexes.
Authors of publication	Bermingham, Michael J.; Cloke, F Geoffrey N; Gardiner, Michael G.; Hitchcock, Peter B.; Wise, Lauren E.; Yates, Brian F.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2005
Journal issue	7
Pages of publication	1157 - 1158
a	10.1459 ± 0.0002 Å
b	17.4901 ± 0.0004 Å
c	20.997 ± 0.0005 Å
α	77.087 ± 0.001°
β	82.899 ± 0.002°
γ	82.008 ± 0.001°
Cell volume	3579.91 ± 0.14 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1079
Residual factor for significantly intense reflections	0.0881
Weighted residual factors for significantly intense reflections	0.222
Weighted residual factors for all reflections included in the refinement	0.2407
Goodness-of-fit parameter for all reflections included in the refinement	1.034
Diffraction radiation probe	x-ray
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
179786 (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 7/00/82.	7008245.cif
120443	2014-07-15	Adding 17924 DOIs guessed from source file names.	7008245.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7008245.cif
1504	2010-09-08	cif/7/ Adding data extracted from RSC 2005 and 2006 year publications.	7008245.cif