Crystallography Open Database

Information card for entry 4064191

Preview

Coordinates	4064191.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C30.25 H57 N2 O Os P2
Calculated formula	C30.25 H54 N2 O Os P2
Title of publication	Osmium NHC Complexes from Alcohol-Functionalized Imidazoles and Imidazolium Salts
Authors of publication	Eguillor, Beatriz; Esteruelas, Miguel A.; García-Raboso, Jorge; Oliván, Montserrat; Oñate, Enrique; Pastor, Isidro M.; Peñafiel, Itziar; Yus, Miguel
Journal of publication	Organometallics
Year of publication	2011
Journal volume	30
Journal issue	6
Pages of publication	1658
a	35.231 ± 0.009 Å
b	35.231 ± 0.009 Å
c	11.818 ± 0.004 Å
α	90°
β	90°
γ	90°
Cell volume	14669 ± 7 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	88
Hermann-Mauguin space group symbol	I 41/a :2
Hall space group symbol	-I 4ad
Residual factor for all reflections	0.1108
Residual factor for significantly intense reflections	0.0398
Weighted residual factors for significantly intense reflections	0.0707
Weighted residual factors for all reflections included in the refinement	0.081
Goodness-of-fit parameter for all reflections included in the refinement	0.803
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
178535 (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 4/06/41.	4064191.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4064191.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4064191.cif
32811	2012-02-10	../uploads/cif-deposit/cod/cif Adding structures of 4064190, 4064191, 4064192 via cif-deposit CGI script.	4064191.cif