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Compare Angles

18 10 26 16 25

Click on entry for experimental details.
Species Name Experimental Angle Calculated Angle Difference
CCl4 Carbon tetrachloride 109.5 109.5 -0.0
CH3CCl3 Ethane, 1,1,1-trichloro- 110.4 109.1 1.3
CH2Cl2 Methylene chloride 112.2 112.5 -0.3
CH3CHCl2 Ethane, 1,1-dichloro- 112.0 110.3 1.7
CH2CCl2 Ethene, 1,1-dichloro- 114.5 116.6 -2.1
CCl2O Phosgene 111.9 111.6 0.4
CBrCl3 Methane, bromotrichloro- 109.7 109.5 0.2
CFCl3 Trichloromonofluoromethane 110.5 110.1 0.4
CF2Cl2 difluorodichloromethane 112.6 111.4 1.1
CF2CCl2 difluorodichloroethylene 119.0 118.4 0.6
CH3CCl2CH3 Propane, 2,2-dichloro- 108.3 108.5 -0.2
CCl2 dichloromethylene 109.2 109.3 -0.1

MP2/cc-pVTZ for aClCCl

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


Differences greater than 3.5 are in the 3.5 bin. Differences less than -2.5 are in the -2.5 bin.

histogram chart 10
histogram chart 8
histogram chart 6
histogram chart 4
histogram chart 2 histogram chart histogram chart
histogram chart 0 histogram chart histogram chart histogram chart histogram chart histogram chart histogram chart
-2.5 -2 -1.5 -1 -0.5 0 0.5 1 1.5 2 2.5 3 3.5
Angle difference calc. - exp. (degrees)

  Species Name Difference (degrees)
Most negative difference CH2CCl2 Ethene, 1,1-dichloro- -2.1
Most positive difference CH3CHCl2 Ethane, 1,1-dichloro- 1.7