Crystallography Open Database

Information card for entry 7707579

Preview

Coordinates	7707579.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C58 H92 Br4 N4 O30 Ru8
Calculated formula	C58 H92 Br4 N4 O30 Ru8
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	20.2618 ± 0.0008 Å
b	19.7427 ± 0.0008 Å
c	21.4241 ± 0.0008 Å
α	90°
β	109 ± 0.001°
γ	90°
Cell volume	8103.2 ± 0.6 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0752
Residual factor for significantly intense reflections	0.0683
Weighted residual factors for significantly intense reflections	0.1673
Weighted residual factors for all reflections included in the refinement	0.1712
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	Yes
Has F_obs	No

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