Crystallography Open Database

Information card for entry 7707587

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Coordinates	7707587.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C50 H42 Br2 Cu6 N2 O34 Ru12
Calculated formula	C50 H42 Br2 Cu6 N2 O34 Ru12
Title of publication	One-pot atmospheric pressure synthesis of [H<sub>3</sub>Ru<sub>4</sub>(CO)<sub>12</sub>]<sup/>.
Authors of publication	Cesari, Cristiana; Bortoluzzi, Marco; Femoni, Cristina; Iapalucci, Maria Carmela; Zacchini, Stefano
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2021
Journal volume	50
Journal issue	27
Pages of publication	9610 - 9622
a	13.7124 ± 0.0012 Å
b	19.7578 ± 0.0017 Å
c	17.3324 ± 0.0015 Å
α	90°
β	111.328 ± 0.004°
γ	90°
Cell volume	4374.2 ± 0.7 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	7
Space group number	10
Hermann-Mauguin space group symbol	P 1 2/m 1
Hall space group symbol	-P 2y
Residual factor for all reflections	0.09
Residual factor for significantly intense reflections	0.0643
Weighted residual factors for significantly intense reflections	0.1579
Weighted residual factors for all reflections included in the refinement	0.1727
Goodness-of-fit parameter for all reflections included in the refinement	1.082
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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