IV.D.4. (XII.A.2.) |
Compare Angles
Click on entry for experimental details.
Species | Name | Experimental Angle | Calculated Angle | Difference |
---|---|---|---|---|
ClNO | Nitrosyl chloride | 113.3 | 113.4 | -0.1 |
CCSD(T)/aug-cc-pVDZ for aONCl
Histogram of angle differences (in degrees) vs number of species
Differences greater than 0.01 are in the 0.01 bin. Differences less than -0.11 are in the -0.11 bin.
10 | ||||||||||||||||||||||||||||||||||||||||
8 | ||||||||||||||||||||||||||||||||||||||||
6 | ||||||||||||||||||||||||||||||||||||||||
4 | ||||||||||||||||||||||||||||||||||||||||
2 | ||||||||||||||||||||||||||||||||||||||||
0 | ||||||||||||||||||||||||||||||||||||||||
-0.11 | -0.1 | -0.09 | -0.08 | -0.07 | -0.06 | -0.05 | -0.04 | -0.03 | -0.02 | -9.99999999999998E-03 | 1.38777878078145E-17 | 0.01 | ||||||||||||||||||||||||||||
Angle difference calc. - exp. (degrees) |
Species | Name | Difference (degrees) | |
---|---|---|---|
Most negative difference | ClNO | Nitrosyl chloride | -0.1 |
Most positive difference | ClNO | Nitrosyl chloride | -0.1 |