Sample | 1Pd | 1Pd·H2O | ||||||
T (K) | 260 | 120 | 260 | 180 | 100 | |||
Spin state | HS | LS | Fe1(HS) | Fe2(HS) | Fe1(LS) | Fe2(HS) | Fe1(LS) | Fe2(LS) |
Fe–N (Å) | 2.158 | 1.960 | 2.168 | 2.174 | 1.987 | 2.156 | 1.961 | 1.963 |
Θ/Σ | 52/23 | 18.7/9.2 | 16/4.8 | 28/14.8 | 19/9.2 | 33/25.2 | 14/5.6 | 29/13.2 |