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Compare Calculated Bonds for S-O

17 01 10 14 40

HF/LANL2DZ

Histogram of Bond lengths (in Å) vs number of species


Values greater than 1.85 are in the 1.85 bin. Values less than 1.45 are in the 1.45 bin.

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1.45 1.50 1.55 1.60 1.65 1.70 1.75 1.80 1.85
bond lengths (Å)

Summary: (Å)
Average bond length Standard deviation
1.630 0.059

  Species Name Bond Length (Å)
Lowest value SO+ sulfur monoxide cation 1.482
Highest value SO- sulfur monoxide anion 1.799

Calculated Bond lengths
Click on entry for all calculated results.
Species Name Bond Length (Å) Atom1 index Atom2 index
SO- sulfur monoxide anion 1.799 1 2
SO Sulfur monoxide 1.573 1 2
SO+ sulfur monoxide cation 1.482 1 2
HSO+ Sulfur Monoxide, S-protonated 1.541 1 2
SOH+ Sulfur Monoxide, protonated 1.608 1 2
HOSH hydrogen thioperoxide 1.750 1 2
SO2- Sulfur dioxide anion 1.643 1 2
    1.643 1 3
SO2 Sulfur dioxide 1.549 1 2
    1.549 1 3
SO2+ Sulfur dioxide cation 1.581 1 2
    1.581 1 3
SSO Disulfur monoxide 1.573 1 2
NSO sulfinyl amidogen 1.681 1 3
SO2H+ protonated sulfur dioxide 1.622 1 2
    1.514 1 3
SO3- Sulfur trioxide anion 1.640 1 2
    1.640 1 3
    1.640 1 4
SO3 Sulfur trioxide 1.569 1 2
    1.569 1 3
    1.569 1 4
SO3+ Sulfur trioxide cation 1.570 1 2
    1.570 1 3
    1.570 1 4
F2SO Thionyl Fluoride 1.555 1 2
SOCl2 thionyl chloride 1.579 1 2
HSO3 Hydroxysulfonyl radical 1.729 1 2
    1.558 1 3
    1.561 1 4
H2SO3 Sulfurous acid 1.632 1 2
    1.694 1 3
    1.694 1 4
CH3SOCH3 Dimethyl sulfoxide 1.733 1 2
SO4-- sulfate 1.643 1 2
    1.643 1 3
    1.643 1 4
    1.643 1 5
SO2F2 Sulfuryl fluoride 1.592 1 2
    1.592 1 3
SO2Cl2 Sulfuryl chloride 1.610 1 2
    1.610 1 3
HSO4- bisulfate anion 1.722 1 2
    1.613 1 3
    1.620 1 4
    1.620 1 5
HSO3F Fluorosulfonic acid 1.664 1 3
    1.605 3 5
    1.599 3 6
H2SO4 Sulfuric acid 1.612 1 2
    1.612 1 3
    1.674 1 4
    1.674 1 5
CH3SO2NH2 methanesulfonamide 1.645 2 4
    1.645 2 5
C2H6O2S Dimethyl sulfone 1.666 1 2
    1.666 1 3
MgSO4 Magnesium Sulfate 1.697 2 3
    1.697 2 4
    1.608 2 5
    1.608 2 6
SOF4 Sulfur tetrafluoride oxide 1.620 1 2
C3H4O2S 2H-Thiete-1,1-dioxide 1.656 1 2
    1.656 1 3
C2H6O3S Sulfurous acid, dimethyl ester 1.622 1 2
    1.697 1 3
    1.697 1 4
C4H6OS Vinyl sulfoxide 1.714 1 2
C3H8O2S (Methylsulfonyl)ethane 1.662 12 13
    1.665 12 14
C4H10OS Diethyl sulfoxide 1.727 14 15