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Geometry for CH2FOH (fluoromethanol) 1A' CS

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

QCISD/3-21G


Point group is C1
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0246 0.5223 0.0511   -0.0450 0.5231 0.0193
F2 1.1673 -0.3171 -0.0308   -1.1538 -0.3642 0.0082
O3 -1.1873 -0.2126 -0.1136   1.1932 -0.1722 -0.1200
H4 0.0765 1.0421 1.0183   -0.1041 1.0995 0.9534
H5 0.0447 1.2403 -0.7715   -0.1056 1.1872 -0.8454
H6 -1.2754 -0.8621 0.6325   1.3180 -0.7701 0.6630
Atom - Atom Distances (Å)
  C1 F2 O3 H4 H5 H6
C1 1.4201 1.4269 1.0992 1.0920 1.9861
F2 1.4201 2.3584 2.0341 2.0577 2.5891
O3 1.4269 2.3584 2.1100 2.0153 0.9931
H4 1.0992 2.0341 2.1100 1.8009 2.3669
H5 1.0920 2.0577 2.0153 1.8009 2.8519
H6 1.9861 2.5891 0.9931 2.3669 2.8519
Maximum atom distance is 2.8519Å 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 111.863
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 O3 H6 108.993 F2 C1 H4 106.991
F2 C1 H5 109.294 O3 C1 H4 112.651
O3 C1 H5 105.503 H4 C1 H5 110.548

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