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DOE OSTI · 1286378

Materials Data on BiH3Ru3(CO)9 by Materials Project

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Abstract

(RuH)3Bi(CO)9 crystallizes in the triclinic P-1 space group. The structure is zero-dimensional and consists of two bismuth molecules, eighteen formaldehyde molecules, and two RuH clusters. In each RuH cluster, there are three inequivalent Ru+2.67+ sites. In the first Ru+2.67+ site, Ru+2.67+ is bonded in a distorted L-shaped geometry to two H1+ atoms. There is one shorter (1.81 Å) and one longer (1.82 Å) Ru–H bond length. In the second Ru+2.67+ site, Ru+2.67+ is bonded in a distorted L-shaped geometry to two H1+ atoms. Both Ru–H bond lengths are 1.81 Å. In the third Ru+2.67+ site, Ru+2.67+ is bonded in a distorted L-shaped geometry to two H1+ atoms. There is one shorter (1.80 Å) and one longer (1.81 Å) Ru–H bond length. There are three inequivalent H1+ sites. In the first H1+ site, H1+ is bonded in a water-like geometry to two Ru+2.67+ atoms. In the second H1+ site, H1+ is bonded in a bent 120 degrees geometry to two Ru+2.67+ atoms. In the third H1+ site, H1+ is bonded in a bent 120 degrees geometry to two Ru+2.67+ atoms.

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36 MATERIALS SCIENCEBi-C-H-O-RuBiH3Ru3(CO)9crystal structure

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2020-04-30. Materials Data on BiH3Ru3(CO)9 by Materials Project. https://doi.org/10.17188/1286378

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36 MATERIALS SCIENCE↗