Crystallography Open Database

Information card for entry 4071656

Preview

Coordinates	4071656.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C39.25 H51 N3 O0.5 P2 Ru
Calculated formula	C39.25 H51 N3 O0.5 P2 Ru
Title of publication	Stable Carbene and Diazoalkane Complexes of the Same Complex System. Synthesis, Structure, and Reactivity of PNP−Ru(II) Fluorenylidene and Diazofluorene Complexes
Authors of publication	Zhang, Jing; Gandelman, Mark; Shimon, Linda J. W.; Milstein, David
Journal of publication	Organometallics
Year of publication	2008
Journal volume	27
Journal issue	14
Pages of publication	3526
a	34.707 ± 0.007 Å
b	14.668 ± 0.003 Å
c	17.259 ± 0.004 Å
α	90°
β	117.57 ± 0.04°
γ	90°
Cell volume	7789 ± 4 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 ± 2 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0692
Residual factor for significantly intense reflections	0.0537
Weighted residual factors for significantly intense reflections	0.1592
Weighted residual factors for all reflections included in the refinement	0.1707
Goodness-of-fit parameter for all reflections included in the refinement	1.095
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
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4071656.cif
120075	2014-07-11	Adding DOIs to range 4/07 structures.	4071656.cif
47256	2012-03-23	cif/4/ Distributing the new range 4 CIFs into their appropriate prefixed subdirectories.	4071656.cif
43960	2012-03-15	../uploads/cif-deposit/cod/cif Adding structures of 4071652, 4071653, 4071654, 4071655, 4071656 via cif-deposit CGI script.	4071656.cif