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Geometry for CH2FOH (fluoromethanol) 1A' CS

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

HSEh1PBE/6-31G**


Point group is C1
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0175 0.5046 0.0481   -0.0002 0.5069 0.0149
F2 1.1281 -0.3087 -0.0281   1.1380 -0.2694 -0.0302
O3 -1.1422 -0.2123 -0.1159   -1.1354 -0.2600 -0.0794
H4 0.0676 1.0178 1.0197   0.0477 1.0843 0.9499
H5 0.0608 1.2296 -0.7698   0.0022 1.1778 -0.8490
H6 -1.2489 -0.7984 0.6412   -1.2073 -0.7986 0.7161
Atom - Atom Distances (Å)
  C1 F2 O3 H4 H5 H6
C1 1.3786 1.3732 1.0999 1.0938 1.9113
F2 1.3786 2.2740 1.9955 2.0137 2.5175
O3 1.3732 2.2740 2.0655 1.9884 0.9634
H4 1.0999 1.9955 2.0655 1.8019 2.2749
H5 1.0938 2.0137 1.9884 1.8019 2.7962
H6 1.9113 2.5175 0.9634 2.2749 2.7962
Maximum atom distance is 2.7962Å 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 111.455
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 O3 H6 108.499 F2 C1 H4 106.703
F2 C1 H5 108.527 O3 C1 H4 112.803
O3 C1 H5 106.867 H4 C1 H5 110.448

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