Crystallography Open Database

Information card for entry 4339183

Preview

Coordinates	4339183.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	AW16
Chemical name	AW16
Formula	C27 H25 F12 N5 O4 Ru
Calculated formula	C27 H25 F11.99 N5 O4 Ru
Title of publication	Synthesis and characterization of ruthenium bis(beta-diketonato) pyridine-imidazole complexes for hydrogen atom transfer.
Authors of publication	Wu, Adam; Masland, Joshua; Swartz, Rodney D.; Kaminsky, Werner; Mayer, James M.
Journal of publication	Inorganic chemistry
Year of publication	2007
Journal volume	46
Journal issue	26
Pages of publication	11190 - 11201
a	10.9792 ± 0.0003 Å
b	12.377 ± 0.0004 Å
c	12.699 ± 0.0005 Å
α	89.131 ± 0.001°
β	80.044 ± 0.002°
γ	65.729 ± 0.002°
Cell volume	1546.44 ± 0.09 Å³
Cell temperature	130 ± 2 K
Ambient diffraction temperature	130 ± 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	0.1037
Residual factor for significantly intense reflections	0.0631
Weighted residual factors for significantly intense reflections	0.1355
Weighted residual factors for all reflections included in the refinement	0.1535
Goodness-of-fit parameter for all reflections included in the refinement	1.059
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
179494 (current)	2016-03-23	cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/91.	4339183.cif
171491	2015-12-13	cif/ (antanas@echidna.ibt.lt) Removing surrounding qoutes ("'") from the _chemical_name_systematic tag values in multiple entries in range 4.	4339183.cif
117185	2014-06-14	cif/ Adding structures of 4339183 via cif-deposit CGI script.	4339183.cif