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18 10 26 16 45

BLYP/6-31G** 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
histogram chart 2 histogram chart histogram chart histogram chart
histogram chart 0 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 ClS2 Sulfur chloride0.049
Most positive difference CH3SSH Hydrogen methyl disulfide0.082

Bond lengths
Click on entry for experimental details.

Species Name Experimental (Å) Difference (Å)
ClS2 Sulfur chloride 1.906 0.049
S2+ sulfur diatomic cation 1.825 0.049
ClSSCl Disulfur dichloride 1.931 0.051
FSSF Difluorodisulfane 1.890 0.067
S2 Sulfur diatomic 1.889 0.067
S3 Sulfur trimer 1.917 0.069
CH3SSCH3 Disulfide, dimethyl 2.038 0.071
H2S2 Disulfane 2.056 0.071
SSO Disulfur monoxide 1.884 0.075
S8 Octasulfur 2.059 0.076
HSSSH trisulfane 2.054 0.078
CH3SSH Hydrogen methyl disulfide 2.038 0.082