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Geometry for CH2FCH2OH (2-fluoroethanol) 1A C1

1910171554
InChI=1S/C2H5FO/c3-1-2-4/h4H,1-2H2 INChIKey=

BLYP/6-31G*


Point group is C1
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.6967 0.5933 0.2780   -0.6818 0.6150 0.2674
C2 -0.7252 0.5806 -0.2779   0.7521 0.5570 -0.2535
O3 1.4447 -0.5375 -0.1863   -1.4578 -0.4834 -0.2277
F4 -1.3458 -0.6177 0.1601   1.3185 -0.6671 0.1862
H5 1.2305 1.4941 -0.0690   -1.1745 1.5379 -0.0825
H6 0.6519 0.6277 1.3875   -0.6636 0.6364 1.3779
H7 -1.3212 1.4371 0.0865   1.3689 1.3878 0.1350
H8 -0.7183 0.5724 -1.3819   0.7725 0.5604 -1.3573
H9 0.8825 -1.3152 0.0257   -0.9291 -1.2829 -0.0106
Atom - Atom Distances (Å)
  C1 C2 O3 F4 H5 H6 H7 H8 H9
C1 1.5268 1.4331 2.3774 1.1031 1.1109 2.1955 2.1813 1.9340
C2 1.5268 2.4428 1.4187 2.1686 2.1616 1.1053 1.1040 2.5041
O3 1.4331 2.4428 2.8131 2.0462 2.1125 3.4093 2.7092 0.9828
F4 2.3774 1.4187 2.8131 3.3390 2.6548 2.0562 2.0464 2.3387
H5 1.1031 2.1686 2.0462 3.3390 1.7907 2.5571 2.5241 2.8323
H6 1.1109 2.1616 2.1125 2.6548 1.7907 2.4982 3.0903 2.3837
H7 2.1955 1.1053 3.4093 2.0562 2.5571 2.4982 1.8076 3.5263
H8 2.1813 1.1040 2.7092 2.0464 2.5241 3.0903 1.8076 2.8472
H9 1.9340 2.5041 0.9828 2.3387 2.8323 2.3837 3.5263 2.8472
Maximum atom distance is 3.5263Å between atoms H7 and H9.
picture of 2-fluoroethanol
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 C2 F4 107.576 C2 C1 O3 111.196
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 C2 H7 112.064 C1 C2 H8 111.002
C1 O3 H9 104.823 C2 C1 H5 110.057
C2 C1 H6 109.053 O3 C1 H5 106.845
O3 C1 H6 111.655

For information on specific bond angles or dihedrals see the geometry comparison page in section Comparisons > Geometry > Bonds, angles.