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Compare Angles

18 10 26 16 25

Click on entry for experimental details.
Species Name Experimental Angle Calculated Angle Difference
CH2F2 Methane, difluoro- 108.5 108.3 0.1
CH3CHF2 Ethane, 1,1-difluoro- 107.4 106.7 0.7
CHF3 Methane, trifluoro- 108.6 108.3 0.3
CF3Br Bromotrifluoromethane 108.8 108.3 0.5
CF2Cl2 difluorodichloromethane 106.2 106.9 -0.7
CF3Cl Methane, chlorotrifluoro- 108.6 108.2 0.4
CF2CCl2 difluorodichloroethylene 112.1 111.6 0.5
CF2O Carbonic difluoride 108.0 107.5 0.5
CF3OF Trifluoromethylhypofluorite 109.4 110.2 -0.8
CF2 Difluoromethylene 104.9 104.1 0.7

QCISD(T)=FULL/6-31+G** for aFCF

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.

histogram chart 10
histogram chart 8
histogram chart 6
histogram chart 4
histogram chart 2 histogram chart
histogram chart 0 histogram chart histogram chart histogram chart histogram chart histogram chart histogram chart
-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 CF3OF Trifluoromethylhypofluorite -0.8
Most positive difference CF2 Difluoromethylene 0.7