Crystallography Open Database

Information card for entry 7048049

Preview

Coordinates	7048049.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C64.05 H74.12 Br N2 O4.51 P3 Ru
Calculated formula	C64.064 H74.128 Br N2 O4.516 P3 Ru
Title of publication	Cationic abnormal N-heterocyclic carbene ruthenium complexes as suitable precursors for the synthesis of heterobimetallic compounds.
Authors of publication	Pardatscher, Lorenz; Bitzer, Mario J.; Jandl, Christian; Kück, Jens W; Reich, Robert M.; Kühn, Fritz E; Baratta, Walter
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2018
Journal volume	48
Journal issue	1
Pages of publication	79 - 89
a	11.784 ± 0.0015 Å
b	20.151 ± 0.003 Å
c	26.982 ± 0.004 Å
α	90°
β	102.446 ± 0.004°
γ	90°
Cell volume	6256.6 ± 1.5 Å³
Cell temperature	100 K
Ambient diffraction temperature	100 K
Number of distinct elements	7
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.044
Residual factor for significantly intense reflections	0.0383
Weighted residual factors for significantly intense reflections	0.1074
Weighted residual factors for all reflections included in the refinement	0.1118
Goodness-of-fit parameter for all reflections included in the refinement	1.052
Diffraction radiation probe	x-ray
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
223948 (current)	2019-11-07	cif/ Updating files of 7048046, 7048047, 7048048, 7048049 Original log message: Adding full bibliography for 7048046--7048049.cif.	7048049.cif
211936	2018-11-14	cif/ Adding structures of 7048046, 7048047, 7048048, 7048049 via cif-deposit CGI script.	7048049.cif