Crystallography Open Database

Information card for entry 4301851

Preview

Coordinates	4301851.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C37 H51 F6 N6 O2 P Ru
Calculated formula	C37 H51 F6 N6 O2 P Ru
Title of publication	Reaction of a (Salen)ruthenium(VI) Nitrido Complex with Isocyanide
Authors of publication	Hoi-Ki Kwong; Wai-Lun Man; Jing Xiang; Wing-Tak Wong; Tai-Chu Lau
Journal of publication	Inorganic Chemistry
Year of publication	2009
Journal volume	48
Pages of publication	3080 - 3086
a	14.031 ± 0.007 Å
b	24.925 ± 0.012 Å
c	14.199 ± 0.007 Å
α	90°
β	116.539 ± 0.007°
γ	90°
Cell volume	4442 ± 4 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	7
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.1134
Residual factor for significantly intense reflections	0.0788
Weighted residual factors for significantly intense reflections	0.2401
Weighted residual factors for all reflections included in the refinement	0.3263
Goodness-of-fit parameter for all reflections included in the refinement	1.308
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
179056 (current)	2016-03-22	cif/4/30/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/30/18.	4301851.cif
120081	2014-07-12	Adding DOIs to range 4/30 structures.	4301851.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4301851.cif
1054	2010-03-28	cif/4/ Adding data extracted in Inorg-Chem-2009_01-10/ processing.	4301851.cif