Crystallography Open Database

Information card for entry 7033243

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Coordinates	7033243.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C38 H49 Cl N4 O2 Ru S
Calculated formula	C38 H49 Cl N4 O2 Ru S
Title of publication	Bis-mixed-carbene ruthenium-thiolate-alkylidene complexes: synthesis and olefin metathesis activity.
Authors of publication	Dahcheh, Fatme; Stephan, Douglas W.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2015
Journal volume	44
Journal issue	4
Pages of publication	1724 - 1733
a	8.7968 ± 0.0003 Å
b	11.7375 ± 0.0004 Å
c	19.4493 ± 0.0007 Å
α	79.242 ± 0.002°
β	88.387 ± 0.001°
γ	68.968 ± 0.001°
Cell volume	1839.81 ± 0.11 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 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 all reflections	0.0818
Residual factor for significantly intense reflections	0.048
Weighted residual factors for significantly intense reflections	0.0966
Weighted residual factors for all reflections included in the refinement	0.1107
Goodness-of-fit parameter for all reflections included in the refinement	1.024
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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