Crystallography Open Database

Information card for entry 4073204

Preview

Coordinates	4073204.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	[Y{C5Me4SiMe2(C?CCH=CHO)}(CH2SiMe3)(THF)2]
Chemical name	[Y(C5Me4{SiMe2(C4H2O)})(CH2SiMe3)(THF)3]
Formula	C27 H45 O3 Si2 Y
Calculated formula	C27 H45 O3 Si2 Y
Title of publication	Ring-Opening of a Furyl Group Appended to the Cyclopentadienyl Ligand in Rare-Earth Metal Half-Sandwich Complexes
Authors of publication	Hitzbleck, Julia; Okuda, Jun
Journal of publication	Organometallics
Year of publication	2007
Journal volume	26
Journal issue	13
Pages of publication	3227
a	16.875 ± 0.004 Å
b	10.176 ± 0.002 Å
c	17.594 ± 0.004 Å
α	90°
β	99.049 ± 0.006°
γ	90°
Cell volume	2983.6 ± 1.1 Å³
Cell temperature	133 ± 2 K
Ambient diffraction temperature	133 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0686
Residual factor for significantly intense reflections	0.0408
Weighted residual factors for significantly intense reflections	0.0934
Weighted residual factors for all reflections included in the refinement	0.106
Goodness-of-fit parameter for all reflections included in the refinement	1.016
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
178621 (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 4/07/32.	4073204.cif
120075	2014-07-11	Adding DOIs to range 4/07 structures.	4073204.cif
47256	2012-03-23	cif/4/ Distributing the new range 4 CIFs into their appropriate prefixed subdirectories.	4073204.cif
46220	2012-03-21	../uploads/cif-deposit/cod/cif Adding structures of 4073202, 4073203, 4073204 via cif-deposit CGI script.	4073204.cif