Crystallography Open Database

Information card for entry 4067744

Preview

Coordinates	4067744.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C71 H101 Fe2 Lu2 N10 Si4
Calculated formula	C71 H101 Fe2 Lu2 N10 Si4
Title of publication	Reactions of Imidazoles with Electrophilic Metal Alkyl Complexes
Authors of publication	Miller, Kevin L.; Carver, Colin T.; Williams, Bryan N.; Diaconescu, Paula L.
Journal of publication	Organometallics
Year of publication	2010
Journal volume	29
Journal issue	10
Pages of publication	2272
a	24.013 ± 0.004 Å
b	19.951 ± 0.003 Å
c	30.915 ± 0.005 Å
α	90°
β	98.393 ± 0.002°
γ	90°
Cell volume	14652 ± 4 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
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	0.0655
Residual factor for significantly intense reflections	0.0413
Weighted residual factors for significantly intense reflections	0.089
Weighted residual factors for all reflections included in the refinement	0.0986
Goodness-of-fit parameter for all reflections included in the refinement	1.023
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
178568 (current)	2016-03-21	cif/4/06/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/06/77.	4067744.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4067744.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4067744.cif
34281	2012-02-13	../uploads/cif-deposit/cod/cif Adding structures of 4067741, 4067742, 4067743, 4067744 via cif-deposit CGI script.	4067744.cif