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Compare Angles

18 10 26 16 25

Click on entry for experimental details.
Species Name Experimental Angle Calculated Angle Difference
CH3CH2OH Ethanol 105.4 107.6 -2.2
HCOOH Formic acid 106.3 107.0 -0.7

B97D3/6-311G* for aHOC

Histogram of angle differences (in degrees) vs number of species


Differences greater than 4.44089209850063E-16 are in the 4.44089209850063E-16 bin. Differences less than -2.4 are in the -2.4 bin.

histogram chart 10
histogram chart 8
histogram chart 6
histogram chart 4
histogram chart 2
histogram chart 0 histogram chart histogram chart
-2.4 -2.2 -2 -1.8 -1.6 -1.4 -1.2 -1 -0.8 -0.6 -0.4 -0.2 4.44089209850063E-16
Angle difference calc. - exp. (degrees)

  Species Name Difference (degrees)
Most negative difference CH3CH2OH Ethanol -2.2
Most positive difference HCOOH Formic acid -0.7