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IV.D.7. (XVIII.A.2.) |
| Species | Name | Bond type | Bond Length (Å) | ||
|---|---|---|---|---|---|
| Experimental | Calculated | Difference | |||
| Al2 | Aluminum diatomic | rAlAl | 2.701 | 2.983 | 0.282 |
| Ne2 | Neon dimer | rNeNe | 3.100 | 2.831 | -0.269 |
| Si2 | Silicon diatomic | rSiSi | 2.246 | 2.077 | -0.169 |
| Na2+ | sodium dimer cation | rNaNa | 3.540 | 3.695 | 0.155 |
| ClF+ | clorine monofluoride cation | rFCl | 1.448 | 1.587 | 0.138 |
| ZnS | Zinc sulfide | rSZn | 2.046 | 2.170 | 0.123 |
| N2O3 | Dinitrogen trioxide | rNN | 1.864 | 1.751 | -0.113 |
| Na2 | Sodium diatomic | rNaNa | 3.079 | 3.164 | 0.085 |
| C2 | Carbon diatomic | rCC | 1.243 | 1.323 | 0.081 |
| AlN | Aluminum nitride | rNAl | 1.786 | 1.710 | -0.076 |
| BN | boron nitride | rBN | 1.325 | 1.251 | -0.074 |
| CO | Carbon monoxide | rCO | 1.206 | 1.133 | -0.073 |
| CO | Carbon monoxide | rCO | 1.206 | 1.133 | -0.073 |
| S2Cl2 | Disulfur dichloride | rSS | 1.931 | 2.000 | 0.069 |
| ClFO3 | Perchloryl fluoride | rFCl | 1.598 | 1.667 | 0.069 |
| BrO | Bromine monoxide | rOBr | 1.718 | 1.777 | 0.059 |
| B2 | Boron diatomic | rBB | 1.590 | 1.533 | -0.057 |
| MgO | magnesium oxide | rMgO | 1.749 | 1.806 | 0.057 |
| SCl | sulfur monochloride | rSCl | 1.975 | 2.029 | 0.054 |
| BHCl2 | Borane, dichloro- | rBH | 1.130 | 1.183 | 0.053 |
| Cl2 | Chlorine diatomic | rClCl | 1.988 | 2.041 | 0.053 |
| LiCl- | lithium chloride anion | rLiCl | 2.180 | 2.128 | -0.052 |
| PCl5 | Phosphorus pentachloride | rPCl | 2.214 | 2.162 | -0.052 |
| NaLi | lithium sodium | rLiNa | 2.889 | 2.940 | 0.051 |
| Se2 | Selenium diatomic | rSeSe | 2.166 | 2.217 | 0.051 |
| ClS2 | Sulfur chloride | rSCl | 2.071 | 2.121 | 0.050 |
| CaCl | calcium monochloride | rClCa | 2.437 | 2.487 | 0.050 |