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Geometry for CH2FOH (fluoromethanol) 1A' CS

1910171554
InChI=1S/CH3FO/c1-3-2/h1H3 INChIKey=XMSZANIMCDLNKA-UHFFFAOYSA-N

MP2/6-311G**


Point group is C1
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0161 0.5090 0.0483   -0.0016 0.5113 0.0145
F2 1.1294 -0.3087 -0.0287   1.1392 -0.2701 -0.0304
O3 -1.1454 -0.2147 -0.1159   -1.1386 -0.2619 -0.0792
H4 0.0685 1.0096 1.0207   0.0494 1.0768 0.9507
H5 0.0637 1.2235 -0.7720   0.0061 1.1712 -0.8517
H6 -1.2308 -0.7915 0.6470   -1.1900 -0.7895 0.7215
Atom - Atom Distances (Å)
  C1 F2 O3 H4 H5 H6
C1 1.3835 1.3783 1.0949 1.0889 1.8985
F2 1.3835 2.2784 1.9911 2.0090 2.5020
O3 1.3783 2.2784 2.0650 1.9902 0.9602
H4 1.0949 1.9911 2.0650 1.8054 2.2521
H5 1.0889 2.0090 1.9902 1.8054 2.7838
H6 1.8985 2.5020 0.9602 2.2521 2.7838
Maximum atom distance is 2.7838Å between atoms H5 and H6.
picture of fluoromethanol
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
F2 C1 O3 111.172
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 O3 H6 107.198 F2 C1 H4 106.323
F2 C1 H5 108.100 O3 C1 H4 112.723
O3 C1 H5 106.959 H4 C1 H5 111.524

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