Exchange interactions (J) and axial zero-field splitting (D) parameters for 1–8 derived from a simultaneous fit of the susceptibility and magnetisation data employing spin-Hamiltonian (1).
| J (cm−1) | |D| (cm−1) | |
|---|---|---|
| 1 | J Ni–Ni = −0.078 (no MX4 guest – fixed for 2–8) | |DNi| = 1.575 (no MX4 guest – fixed for 2–8) |
| 2 | J Ni–Mn = −0.041 | Neglected for MnII |
| 3 | J Ni–Fe = −0.068 | Neglected for FeIII |
| 4 | J Ni–Fe = −0.084 | Neglected for FeIII |
| 5 | J Ni–Co = −0.005 | |DCo| = 2.37 |
| 6 | J Ni–Co = −0.001 | |DCo| = 6.30 |
| 7 | J′Ni–Ni = −0.476 | |D′Ni| = 85.5 |
| 8 | J Ni–Cu = −0.062 | Neglected for CuII |