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Geometry for CH2OH (Hydroxymethyl radical) 2A C1

1910171554
InChI=1S/CH3O/c1-2/h2H,1H2 INChIKey=CBOIHMRHGLHBPB-UHFFFAOYSA-N

B2PLYP/6-31G*


Point group is C1
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 -0.6867 0.0293 -0.0799   -0.6893 -0.0064 -0.0596
O2 0.6717 -0.1255 0.0293   0.6779 -0.0899 0.0084
H3 -1.2235 -0.8883 0.1167   -1.1709 -0.9532 0.1420
H4 -1.1223 0.9786 0.2185   -1.1654 0.9154 0.2622
H5 1.0925 0.7381 -0.0904   1.0488 0.7959 -0.1136
Atom - Atom Distances (Å)
  C1 O2 H3 H4 H5
C1 1.3715 1.0812 1.0863 1.9151
O2 1.3715 2.0448 2.1149 0.9681
H3 1.0812 2.0448 1.8724 2.8376
H4 1.0863 2.1149 1.8724 2.2491
H5 1.9151 0.9681 2.8376 2.2491
Maximum atom distance is 2.8376Å between atoms H3 and H5.
picture of Hydroxymethyl radical
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 H5 108.662 O2 C1 H3 112.428
O2 C1 H4 118.288 H3 C1 H4 119.513

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