http://www.ilpi.com/organomet/phosphine.html WebMay 16, 2016 · In our calculations of the maximum and minimum cone-angle conformer, five phosphines have cone angles between the range of those of PPh 3 and P o Tol 3 ( Table 1 ). Therefore, we used these...

Computational assessment on the Tolman cone angles for P-ligands

WebSep 3, 2024 · The Tolman cone angle (θ), the par excellence descriptor of the steric measure of a phosphine, has been recomputed for a set of 119 P-ligands, including simple phosphanes and phosphites, as... notes on supermanifolds and integration

Phosphines cone angles - Big Chemical Encyclopedia

http://alpha.chem.umb.edu/chemistry/ch611/documents/Lec6-PhosphineCarbeneLigands.pdf WebJan 15, 2024 · Cone angle can be defined as a solid angle at metal at a M—P distance of 228 pm which encloses the van der Waal’s surfaces of all ligand atoms or substituents … The Tolman cone angle method assumes empirical bond data and defines the perimeter as the maximum possible circumscription of an idealized free-spinning substituent. The metal-ligand bond length in the Tolman model was determined empirically from crystal structures of tetrahedral nickel … See more In coordination chemistry, the ligand cone angle (a common example being the Tolman cone angle or θ) is a measure of the steric bulk of a ligand in a transition metal coordination complex. It is defined as the See more The concept of cone angle is most easily visualized with symmetrical ligands, e.g. PR3. But the approach has been refined to include less symmetrical ligands of the type PRR′R″ as well as diphosphines. In such asymmetric cases, the substituent angles' half angles, … See more The concept of cone angle is of practical importance in homogeneous catalysis because the size of the ligand affects the reactivity of the attached metal center. In an example, the … See more • Bite angle • Steric effects (versus electronic effects) • Tolman electronic parameter See more notes on structure of atoms