Crystallography Open Database

Information card for entry 4069773

Preview

Coordinates	4069773.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C61 H104 N4 O14 P4 Ru4
Calculated formula	C61 H104 N4 O14 P4 Ru4
Title of publication	Formation of Stabletrans-Dihydride Ruthenium(II) and 16-Electron Ruthenium(0) Complexes Based on Phosphinite PONOP Pincer Ligands. Reactivity toward Water and Electrophiles
Authors of publication	Salem, Hiyam; Shimon, Linda J. W.; Diskin-Posner, Yael; Leitus, Gregory; Ben-David, Yehoshoa; Milstein, David
Journal of publication	Organometallics
Year of publication	2009
Journal volume	28
Journal issue	16
Pages of publication	4791
a	9.4286 ± 0.0004 Å
b	14.0069 ± 0.0005 Å
c	14.7373 ± 0.0005 Å
α	103.079 ± 0.002°
β	99.442 ± 0.002°
γ	107.519 ± 0.002°
Cell volume	1750.49 ± 0.12 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0356
Residual factor for significantly intense reflections	0.029
Weighted residual factors for significantly intense reflections	0.0718
Weighted residual factors for all reflections included in the refinement	0.0774
Goodness-of-fit parameter for all reflections included in the refinement	1.051
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
178586 (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 4/06/97.	4069773.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4069773.cif
40439	2012-03-07	../uploads/cif-deposit/cod/cif Adding structures of 4069769, 4069770, 4069771, 4069772, 4069773, 4069774, 4069775, 4069776 via cif-deposit CGI script.	4069773.cif