Materials Data on Sb4RuC6(O3F11)2 by Materials Project

Abstract

Ru(CO)6(Sb2F11)2 crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of twelve formaldehyde molecules, two ruthenium molecules, and four Sb2F11 clusters. In each Sb2F11 cluster, there are two inequivalent Sb+1.50+ sites. In the first Sb+1.50+ site, Sb+1.50+ is bonded to six F1- atoms to form corner-sharing SbF6 octahedra. The corner-sharing octahedral tilt angles are 33°. There are a spread of Sb–F bond distances ranging from 1.89–2.11 Å. In the second Sb+1.50+ site, Sb+1.50+ is bonded to six F1- atoms to form corner-sharing SbF6 octahedra. The corner-sharing octahedral tilt angles are 33°. There are a spread of Sb–F bond distances ranging from 1.89–2.06 Å. There are eleven inequivalent F1- sites. In the first F1- site, F1- is bonded in a single-bond geometry to one Sb+1.50+ atom. In the second F1- site, F1- is bonded in a single-bond geometry to one Sb+1.50+ atom. In the third F1- site, F1- is bonded in a single-bond geometry to one Sb+1.50+ atom. In the fourth F1- site, F1- is bonded in a single-bond geometry to one Sb+1.50+ atom. In the fifth F1- site, F1- is bonded in a single-bond geometry to one Sb+1.50+ atom. In the sixth F1- site, F1- is bonded in a bent 150 degrees geometry to two Sb+1.50+ atoms. In the seventh F1- site, F1- is bonded in a single-bond geometry to one Sb+1.50+ atom. In the eighth F1- site, F1- is bonded in a single-bond geometry to one Sb+1.50+ atom. In the ninth F1- site, F1- is bonded in a single-bond geometry to one Sb+1.50+ atom. In the tenth F1- site, F1- is bonded in a single-bond geometry to one Sb+1.50+ atom. In the eleventh F1- site, F1- is bonded in a single-bond geometry to one Sb+1.50+ atom.