Crystallography Open Database

Information card for entry 4072968

Preview

Coordinates	4072968.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C25 H63 O4 Si6 Tm
Calculated formula	C25 H63 O4 Si6 Tm
SMILES	[Tm]123([O]([Si](C)(C)[C@@]2([Si](C)(C)C)[Si](C)(C)CC[Si](C)(C)[C@@]3([Si](C)(C)C)[Si]([O]1C)(C)C)C)(OC)[O]1CCCC1
Title of publication	Synthesis and Structures of Ln(II) and Ln(III) Dialkyls Derived from LnI2(Ln = Nd, Tm, Yb)
Authors of publication	Bowman, Lyndsey J.; Izod, Keith; Clegg, William; Harrington, Ross W.
Journal of publication	Organometallics
Year of publication	2007
Journal volume	26
Journal issue	10
Pages of publication	2646
a	23.6067 ± 0.0015 Å
b	9.6827 ± 0.0006 Å
c	16.084 ± 0.001 Å
α	90°
β	90°
γ	90°
Cell volume	3676.4 ± 0.4 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	5
Space group number	33
Hermann-Mauguin space group symbol	P n a 21
Hall space group symbol	P 2c -2n
Residual factor for all reflections	0.0527
Residual factor for significantly intense reflections	0.049
Weighted residual factors for significantly intense reflections	0.0897
Weighted residual factors for all reflections included in the refinement	0.0907
Goodness-of-fit parameter for all reflections included in the refinement	1.372
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
178618 (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 4/07/29.	4072968.cif
120075	2014-07-11	Adding DOIs to range 4/07 structures.	4072968.cif
47256	2012-03-23	cif/4/ Distributing the new range 4 CIFs into their appropriate prefixed subdirectories.	4072968.cif
46088	2012-03-21	../uploads/cif-deposit/cod/cif Adding structures of 4072966, 4072967, 4072968, 4072969 via cif-deposit CGI script.	4072968.cif