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Compare Bonds

18 10 26 16 45

CCSD(T)=FULL/TZVP for rSS

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


Differences greater than 0.110 are in the 0.110 bin. Differences less than -0.010 are in the -0.010 bin.

histogram chart 10
histogram chart 8
histogram chart 6
histogram chart 4
histogram chart 2 histogram chart
histogram chart 0 histogram chart histogram chart histogram chart histogram chart
-0.010 0.000 0.010 0.020 0.030 0.040 0.050 0.060 0.070 0.080 0.090 0.100 0.110
bond length difference calc. - exp. (Å)

  Species Name Difference (Å)
Most negative difference S4 Sulfur tetramer0.043
Most positive difference S4 Sulfur tetramer0.111

Bond lengths
Click on entry for experimental details.

Species Name Experimental (Å) Difference (Å)
S4 Sulfur tetramer 1.898 0.043
S2 Sulfur diatomic 1.889 0.045
HSSSH trisulfane 2.054 0.046
H2S2 Disulfane 2.056 0.047
S3 Sulfur trimer 1.917 0.051
SSO Disulfur monoxide 1.884 0.055
CH3SSH Hydrogen methyl disulfide 2.038 0.057
S4 Sulfur tetramer 2.155 0.111