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Geometry for CH2FCH2OH (2-fluoroethanol) 1A C1

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

B3PW91/6-31G


Point group is C1
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.6831 0.5953 0.2909   -0.6542 0.6220 -0.3012
C2 -0.7100 0.5929 -0.2878   0.7231 0.5644 0.3115
O3 1.4439 -0.5325 -0.1898   -1.4661 -0.4827 0.1487
F4 -1.3549 -0.6226 0.1601   1.3356 -0.6688 -0.1334
H5 1.2268 1.4872 -0.0291   -1.1739 1.5295 0.0149
H6 0.6270 0.5995 1.3886   -0.5707 0.6350 -1.3971
H7 -1.3117 1.4375 0.0592   1.3627 1.3904 -0.0116
H8 -0.6882 0.5605 -1.3798   0.6730 0.5221 1.4022
H9 0.9507 -1.3498 0.0208   -0.9969 -1.3149 -0.0585
Atom - Atom Distances (Å)
  C1 C2 O3 F4 H5 H6 H7 H8 H9
C1 1.5085 1.4429 2.3777 1.0925 1.0991 2.1776 2.1617 1.9819
C2 1.5085 2.4322 1.4470 2.1490 2.1443 1.0935 1.0927 2.5743
O3 1.4429 2.4322 2.8221 2.0377 2.1072 3.3965 2.6752 0.9776
F4 2.3777 1.4470 2.8221 3.3395 2.6326 2.0630 2.0531 2.4216
H5 1.0925 2.1490 2.0377 3.3395 1.7770 2.5405 2.5201 2.8508
H6 1.0991 2.1443 2.1072 2.6326 1.7770 2.4955 3.0652 2.4032
H7 2.1776 1.0935 3.3965 2.0630 2.5405 2.4955 1.7968 3.5901
H8 2.1617 1.0927 2.6752 2.0531 2.5201 3.0652 1.7968 2.8804
H9 1.9819 2.5743 0.9776 2.4216 2.8508 2.4032 3.5901 2.8804
Maximum atom distance is 3.5901Å 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 107.108 C2 C1 O3 110.973
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 C2 H7 112.651 C1 C2 H8 111.408
C1 O3 H9 108.396 C2 C1 H5 110.401
C2 C1 H6 109.635 O3 C1 H5 106.143
O3 C1 H6 111.264

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