Crystallography Open Database

Information card for entry 7103930

Preview

Coordinates	7103930.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	[RuCl(Me5Cp)(C6H12N3)2]
Formula	C24 H43 Cl3 N6 P2 Ru x
Calculated formula	C24 H39 Cl3 N6 P2 Ru
Authors of publication	Dina N. Akbayeva; Luca Gonsalvi; Werner Oberhauser; Maurizio Peruzzini; Francesco Vizza; Peter Brueggeller; Antonio Romerosa; Gianni Sava; Alberta Bergamo
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2003
a	12.5986 ± 0.0002 Å
b	16.2139 ± 0.0003 Å
c	16.3454 ± 0.0003 Å
α	64.0661 ± 0.0008°
β	82.934 ± 0.001°
γ	80.159 ± 0.001°
Cell volume	2954.1 ± 0.1 Å³
Cell temperature	213 ± 2 K
Ambient diffraction temperature	213 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for significantly intense reflections	0.0548
Weighted residual factors for significantly intense reflections	0.1085
Goodness-of-fit parameter for all reflections included in the refinement	1.093
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
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.	7103930.cif
120443	2014-07-15	Adding 17924 DOIs guessed from source file names.	7103930.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7103930.cif
966	2010-01-30	cif/ Adding _cod_database_code tags to all COD entries. Adding tag description to the cif_cod.dic dictionary so that COD entries can be validated.	7103930.cif
919	2009-12-07	cif/7/ Fixing values that started with a square bracket ("[") in 36 series 7 files (enclosing such values in single quotes).	7103930.cif
823	2009-09-25	cif/ Depositing information from the Chem-Comm-2003_01-17 and J-Org-Chem-2007_13-20 publications.	7103930.cif