IV.D.4. (XII.A.2.) |
Compare Angles
Click on entry for experimental details.
Species | Name | Experimental Angle | Calculated Angle | Difference |
---|---|---|---|---|
F2SO | Thionyl Fluoride | 106.8 | 102.1 | 4.8 |
SOF4 | Sulfur tetrafluoride oxide | 97.7 | 96.4 | 1.3 |
SOF4 | Sulfur tetrafluoride oxide | 123.6 | 129.3 | -5.7 |
BLYP/STO-3G for aOSF
Histogram of angle differences (in degrees) vs number of species
Differences greater than 6 are in the 6 bin. Differences less than -6 are in the -6 bin.
10 | ||||||||||||||||||||||||||||||||||||||||
8 | ||||||||||||||||||||||||||||||||||||||||
6 | ||||||||||||||||||||||||||||||||||||||||
4 | ||||||||||||||||||||||||||||||||||||||||
2 | ||||||||||||||||||||||||||||||||||||||||
0 | ||||||||||||||||||||||||||||||||||||||||
-6 | -5 | -4 | -3 | -2 | -1 | 0 | 1 | 2 | 3 | 4 | 5 | 6 | ||||||||||||||||||||||||||||
Angle difference calc. - exp. (degrees) |
Species | Name | Difference (degrees) | |
---|---|---|---|
Most negative difference | SOF4 | Sulfur tetrafluoride oxide | -5.7 |
Most positive difference | F2SO | Thionyl Fluoride | 4.8 |