Table 2. Select Bond Distances (Å) from DFT Calculations.
| none | CN– | F– | N3– | OCN– | NO3– | |
|---|---|---|---|---|---|---|
| MnV–O | 1.549 | 1.568 | 1.568 | 1.568 | 1.561 | 1.557 |
| MnV–X | – | 2.146 | 1.931 | 2.354 | 2.420 | 2.518 |
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