Crystallography Open Database

Information card for entry 4069728

Preview

Coordinates	4069728.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C121 H82 B2 Cl2 F40 Ir2 N4 Si2
Calculated formula	C121 H82 B2 Cl2 F40 Ir2 N4 Si2
Title of publication	Synthesis and Reactivity of Iridium and Rhodium Silyl Complexes Supported by a Bipyridine Ligand
Authors of publication	McBee, Jennifer L.; Tilley, T. Don
Journal of publication	Organometallics
Year of publication	2009
Journal volume	28
Journal issue	17
Pages of publication	5072
a	10.357 ± 0.002 Å
b	20.25 ± 0.004 Å
c	27.327 ± 0.006 Å
α	83.719 ± 0.003°
β	82.617 ± 0.003°
γ	88.458 ± 0.003°
Cell volume	5649 ± 2 Å³
Cell temperature	153 ± 2 K
Ambient diffraction temperature	153 ± 2 K
Number of distinct elements	8
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0601
Residual factor for significantly intense reflections	0.037
Weighted residual factors for significantly intense reflections	0.0734
Weighted residual factors for all reflections included in the refinement	0.0792
Goodness-of-fit parameter for all reflections included in the refinement	1.054
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
176432 (current)	2016-02-14	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries.	4069728.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4069728.cif
40415	2012-03-07	../uploads/cif-deposit/cod/cif Adding structures of 4069728 via cif-deposit CGI script.	4069728.cif