IV.D.4. (XII.A.2.) |
Compare Angles
Click on entry for experimental details.
Species | Name | Experimental Angle | Calculated Angle | Difference |
---|---|---|---|---|
HOF | Hypofluorous acid | 97.2 | 97.2 | -0.0 |
QCISD(T)=FULL/daug-cc-pVDZ for aHOF
Histogram of angle differences (in degrees) vs number of species
Differences greater than 0.006 are in the 0.006 bin. Differences less than -0.018 are in the -0.018 bin.
10 | ||||||||||||||||||||||||||||||||||||||||
8 | ||||||||||||||||||||||||||||||||||||||||
6 | ||||||||||||||||||||||||||||||||||||||||
4 | ||||||||||||||||||||||||||||||||||||||||
2 | ||||||||||||||||||||||||||||||||||||||||
0 | ||||||||||||||||||||||||||||||||||||||||
-0.018 | -0.016 | -0.014 | -0.012 | -0.01 | -0.008 | -0.006 | -0.004 | -0.002 | 0 | 0.002 | 0.004 | 0.006 | ||||||||||||||||||||||||||||
Angle difference calc. - exp. (degrees) |
Species | Name | Difference (degrees) | |
---|---|---|---|
Most negative difference | HOF | Hypofluorous acid | -0.0 |
Most positive difference | HOF | Hypofluorous acid | -0.0 |