Complexes | Structure electronic of Ru | valence electrons | ||||||
α-RuCl2(Dazpy)2 | Structure | (4dyz)1.89 | (4dxy)1.68 | (4dz²)1.37 | (4dxz)0.95 | (4dx² − y²)1.19 | (5s)0.27 | 7.35 |
Energy | −0.221 | −0.215 | −0.202 | −0.199 | −0.187 | 0.208 | ||
β-RuCl2(Dazpy)2 | Structure | (4dxy)1.94 | (4dxz)1.70 | (4dz²)1.36 | (4dyz)1.09 | (4dx² − y²)0.99 | (5s)0.28 | 7.36 |
Energy | −0.237 | −0.224 | −0.212 | −0.204 | −0.186 | 0.231 | ||
γ-RuCl2(Dazpy)2 | Structure | (4dx² − y²)1.67 | (4dz²)1.69 | (4dyz)1.50 | (4dxy)1.09 | (4dxz)1.14 | (5s)0.28 | 7.37 |
Energy | −0.227 | −0.212 | −0.206 | −0.199 | −0.188 | 0.237 | ||
δ-RuCl2(Dazpy)2 | Structure | (4dyz)1.93 | (4dxy)1.81 | (4dxz)1.57 | (4dz²)0.89 | (4dx² − y²)0.91 | (5s)0.27 | 7.38 |
Energy | −0.222 | −0.217 | −0.215 | −0.181 | −0.170 | 0.217 | ||
ε-RuCl2(Dazpy)2 | Structure | (4dx² − y²)1.67 | (4dxz)1.38 | (4dz²)1.63 | (4dxy)1.10 | (4dyz)1.31 | (5s)0.27 | 7.36 |
Energy | −0.222 | −0.213 | −0.212 | −0.193 | −0.192 | 0.221 | ||
RuCl3.3H2O | Structure | (4dxy)1.99 | (4dyz)1.99 | (4dxz)1.21 | (4dz²)0.83 | (4dx² − y²)0.76 | (5s)0.28 | 7.06 |
Energy | −0.290 | −0.288 | −0.263 | −0.249 | −0.232 | 0.235 | ||
Ru atom | Structure | (4dxy)2 | (4dxz)2 | (4dyz)2 | (4dz²)1.51 | (5s)0.49 | (4dx² − y²)0 | 8 |
Energy | −0.200 | −0.181 | −0.180 | −0.148 | −0.119 | −0.100 |