Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology | |
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Species | Name | Bond type | Bond Length (Å) | ||
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Experimental | Calculated | Difference | |||
HSSSH | trisulfane | rHS | 1.344 | 2.063 | 0.719 |
HSSSH | trisulfane | rHS | 1.344 | 2.063 | 0.719 |
HSSSH | trisulfane | rHS | 1.344 | 2.062 | 0.719 |
HSSSH | trisulfane | rHS | 1.344 | 2.062 | 0.719 |
Al2Cl6 | Aluminum, di-μ-chlorotetrachlorodi- | rAlCl | 2.040 | 2.274 | 0.234 |
Al2Cl6 | Aluminum, di-μ-chlorotetrachlorodi- | rAlCl | 2.240 | 2.083 | -0.157 |
SiC | silicon monocarbide | rCSi | 1.722 | 1.652 | -0.070 |