Crystallography Open Database

Information card for entry 4084844

Preview

Coordinates	4084844.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C38 H44 F12 N O2 P Ru Sb2
Calculated formula	C38 H44 F12 N O2 P Ru Sb2
Title of publication	Reactivity of the Chiral Metallic Brønsted Acid [(η6-p-MeC6H4iPr)Ru(κ3P,O,O′-POH)][SbF6]2(POH= (SC1,RC2)-Ph2PC(Ph)HC(OH)HCH2OMe) toward Aldimines
Authors of publication	Pardo, Pilar; Carmona, Daniel; Lamata, Pilar; Rodr\?íguez, Ricardo; Lahoz, Fernando J.; Garc\?ía-Orduña, Pilar; Oro, Luis A.
Journal of publication	Organometallics
Year of publication	2014
Journal volume	33
Journal issue	23
Pages of publication	6927
a	29.518 ± 0.003 Å
b	10.8722 ± 0.0011 Å
c	12.9904 ± 0.0014 Å
α	90°
β	94.993 ± 0.002°
γ	90°
Cell volume	4153.1 ± 0.7 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	8
Space group number	5
Hermann-Mauguin space group symbol	C 1 2 1
Hall space group symbol	C 2y
Residual factor for all reflections	0.0803
Residual factor for significantly intense reflections	0.0556
Weighted residual factors for significantly intense reflections	0.1046
Weighted residual factors for all reflections included in the refinement	0.114
Goodness-of-fit parameter for all reflections included in the refinement	1.034
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
178737 (current)	2016-03-21	cif/4/08/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/08/48.	4084844.cif
131496	2015-02-08	cif/ Updating files of 4084843, 4084844 Original log message: Adding full bibliography for 4084843--4084844.cif.	4084844.cif
127758	2014-11-21	cif/ Adding structures of 4084843, 4084844 via cif-deposit CGI script.	4084844.cif