Crystallography Open Database

Information card for entry 7016986

Preview

Coordinates	7016986.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C56 H91 B2 Co2 F8 N6 O18.5 P6 Ru2
Calculated formula	C56 H91 B2 Co2 F8 N6 O18.5 P6 Ru2
Title of publication	Synthesis, structures and reactivity of ruthenium nitrosyl complexes containing Kläui's oxygen tripodal ligand.
Authors of publication	Ip, Ho-Fai; Yi, Xiao-Yi; Wong, Wai-Yeung; Williams, Ian D.; Leung, Wa-Hung
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2011
Journal volume	40
Journal issue	41
Pages of publication	11043 - 11050
a	21.501 ± 0.003 Å
b	14.5812 ± 0.0019 Å
c	26.604 ± 0.003 Å
α	90°
β	103.057 ± 0.002°
γ	90°
Cell volume	8125 ± 1.8 Å³
Cell temperature	173 K
Ambient diffraction temperature	175 K
Number of distinct elements	9
Space group number	5
Hermann-Mauguin space group symbol	C 1 2 1
Hall space group symbol	C 2y
Residual factor for all reflections	0.0898
Residual factor for significantly intense reflections	0.0541
Weighted residual factors for significantly intense reflections	0.0971
Weighted residual factors for all reflections included in the refinement	0.105
Goodness-of-fit parameter for all reflections included in the refinement	1.035
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
176453 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7.	7016986.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7016986.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7016986.cif
30010	2011-11-09	../uploads/cif-deposit/cod/cif Adding structures of 7016982, 7016983, 7016984, 7016985, 7016986, 7016987 via cif-deposit CGI script.	7016986.cif