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18 10 26 16 45

CCD/6-311G* for rSS

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


Differences greater than 0.080 are in the 0.080 bin. Differences less than -0.040 are in the -0.040 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 histogram chart histogram chart histogram chart
-0.040 -0.030 -0.020 -0.010 0.000 0.010 0.020 0.030 0.040 0.050 0.060 0.070 0.080
bond length difference calc. - exp. (Å)

  Species Name Difference (Å)
Most negative difference S4 Sulfur tetramer-0.031
Most positive difference ClSSCl Disulfur dichloride0.072

Bond lengths
Click on entry for experimental details.

Species Name Experimental (Å) Difference (Å)
S4 Sulfur tetramer 2.155 -0.031
S2+ sulfur diatomic cation 1.825 0.007
SSO Disulfur monoxide 1.884 0.012
S3 Sulfur trimer 1.917 0.015
S2 Sulfur diatomic 1.889 0.020
S8 Octasulfur 2.059 0.024
S4 Sulfur tetramer 1.898 0.025
HSSSH trisulfane 2.054 0.032
H2S2 Disulfane 2.056 0.035
CH3SSCH3 Disulfide, dimethyl 2.038 0.038
CH3SSH Hydrogen methyl disulfide 2.038 0.046
FSSF Difluorodisulfane 1.890 0.055
ClSSCl Disulfur dichloride 1.931 0.072