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 |
CCSD(T)=FULL/aug-cc-pVDZ for aHOF
Histogram of angle differences (in degrees) vs number of species
Differences greater than 0.011 are in the 0.011 bin. Differences less than -0.001 are in the -0.001 bin.
10 | ||||||||||||||||||||||||||||||||||||||||
8 | ||||||||||||||||||||||||||||||||||||||||
6 | ||||||||||||||||||||||||||||||||||||||||
4 | ||||||||||||||||||||||||||||||||||||||||
2 | ||||||||||||||||||||||||||||||||||||||||
0 | ||||||||||||||||||||||||||||||||||||||||
-0.001 | 0 | 0.001 | 0.002 | 0.003 | 0.004 | 0.005 | 0.006 | 0.007 | 0.008 | 0.009 | 0.01 | 0.011 | ||||||||||||||||||||||||||||
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 |