Crystallography Open Database

Information card for entry 4071489

Preview

Coordinates	4071489.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C38 H54 Fe2 Li4 N2
Calculated formula	C38 H54 Fe2 Li4 N2
Title of publication	Structural Features of Lithio[3]ferrocenophane Systems Bearing Stabilizing Dimethylamino Substituents
Authors of publication	Chen, Chao; Fröhlich, Roland; Kehr, Gerald; Erker, Gerhard
Journal of publication	Organometallics
Year of publication	2008
Journal volume	27
Journal issue	13
Pages of publication	3248
a	21.6614 ± 0.0003 Å
b	10.6671 ± 0.0002 Å
c	19.0435 ± 0.0003 Å
α	90°
β	124.613 ± 0.001°
γ	90°
Cell volume	3621.46 ± 0.11 Å³
Cell temperature	198 ± 2 K
Ambient diffraction temperature	198 ± 2 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0525
Residual factor for significantly intense reflections	0.0371
Weighted residual factors for significantly intense reflections	0.0943
Weighted residual factors for all reflections included in the refinement	0.1023
Goodness-of-fit parameter for all reflections included in the refinement	1.035
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
178603 (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 4/07/14.	4071489.cif
120075	2014-07-11	Adding DOIs to range 4/07 structures.	4071489.cif
47256	2012-03-23	cif/4/ Distributing the new range 4 CIFs into their appropriate prefixed subdirectories.	4071489.cif
43863	2012-03-15	../uploads/cif-deposit/cod/cif Adding structures of 4071489 via cif-deposit CGI script.	4071489.cif