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Geometry for CH3OH (Methyl alcohol) 1A' CS

1910171554
InChI=1S/CH4O/c1-2/h2H,1H3 INChIKey=OKKJLVBELUTLKV-UHFFFAOYSA-N

CBS-Q


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 -0.0457 0.6542 0.0000   0.6510 -0.0795 0.0000
O2 -0.0457 -0.7447 0.0000   -0.7461 -0.0070 0.0000
H3 -1.0820 0.9725 0.0000   0.9151 -1.1310 0.0000
H4 0.4411 1.0631 0.8864   1.0845 0.3854 0.8864
H5 0.4411 1.0631 -0.8864   1.0845 0.3854 -0.8864
H6 0.8393 -1.0665 0.0000   -1.0215 0.8934 0.0000
Atom - Atom Distances (Å)
  C1 O2 H3 H4 H5 H6
C1 1.3989 1.0841 1.0908 1.0908 1.9349
O2 1.3989 2.0057 2.0714 2.0714 0.9416
H3 1.0841 2.0057 1.7646 1.7646 2.8016
H4 1.0908 2.0714 1.7646 1.7728 2.3408
H5 1.0908 2.0714 1.7646 1.7728 2.3408
H6 1.9349 0.9416 2.8016 2.3408 2.3408
Maximum atom distance is 2.8016Å between atoms H3 and H6.
picture of Methyl alcohol
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 O2 H6 109.983 O2 C1 H3 107.073
O2 C1 H4 112.013 O2 C1 H5 112.013
H3 C1 H4 108.455 H3 C1 H5 108.455
H4 C1 H5 108.707

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