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 | 107.0 | -0.2 |
SOF4 | Sulfur tetrafluoride oxide | 97.7 | 98.7 | -1.0 |
SOF4 | Sulfur tetrafluoride oxide | 123.6 | 123.3 | 0.3 |
QCISD/3-21G* for aOSF
Histogram of angle differences (in degrees) vs number of species
Differences greater than 1.4 are in the 1.4 bin. Differences less than -1 are in the -1 bin.
10 | ||||||||||||||||||||||||||||||||||||||||
8 | ||||||||||||||||||||||||||||||||||||||||
6 | ||||||||||||||||||||||||||||||||||||||||
4 | ||||||||||||||||||||||||||||||||||||||||
2 | ||||||||||||||||||||||||||||||||||||||||
0 | ||||||||||||||||||||||||||||||||||||||||
-1 | -0.8 | -0.6 | -0.4 | -0.2 | 0 | 0.2 | 0.4 | 0.6 | 0.8 | 1 | 1.2 | 1.4 | ||||||||||||||||||||||||||||
Angle difference calc. - exp. (degrees) |
Species | Name | Difference (degrees) | |
---|---|---|---|
Most negative difference | SOF4 | Sulfur tetrafluoride oxide | -1.0 |
Most positive difference | SOF4 | Sulfur tetrafluoride oxide | 0.3 |