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18 10 26 16 45

B3PW91/STO-3G for rSiBr

Histogram of Bond length differences (in Å) vs number of species


Differences greater than 0.055 are in the 0.055 bin. Differences less than -0.005 are in the -0.005 bin.

histogram chart 10
histogram chart 8
histogram chart 6
histogram chart 4
histogram chart 2
histogram chart 0 histogram chart histogram chart histogram chart histogram chart
-0.005 0.000 0.005 0.010 0.015 0.020 0.025 0.030 0.035 0.040 0.045 0.050 0.055
bond length difference calc. - exp. (Å)

  Species Name Difference (Å)
Most negative difference HSiBr monobromosilylene0.001
Most positive difference SiBr+ Silicon monobromide cation0.042

Bond lengths
Click on entry for experimental details.

Species Name Experimental (Å) Difference (Å)
HSiBr monobromosilylene 2.237 0.001
SiH3Br bromosilane 2.210 0.004
SiBr Silicon monobromide 2.209 0.022
SiBr4 Silicon tetrabromide 2.183 0.041
SiBr+ Silicon monobromide cation 2.095 0.042