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Geometry for CH2OH (Hydroxymethyl radical) 2A C1

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

B3LYP/aug-cc-pVQZ


Point group is C1
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.6838 0.0275 -0.0563   -0.6799 0.0658 -0.0698
O2 -0.6690 -0.1257 0.0189   0.6607 -0.1623 0.0302
H3 1.2362 -0.8847 0.0911   -1.2840 -0.8176 0.0483
H4 1.1158 0.9963 0.1465   -1.0632 1.0527 0.1431
H5 -1.1026 0.7286 -0.0508   1.1412 0.6683 -0.0138
Atom - Atom Distances (Å)
  C1 O2 H3 H4 H5
C1 1.3635 1.0766 1.0800 1.9191
O2 1.3635 2.0522 2.1120 0.9606
H3 1.0766 2.0522 1.8857 2.8449
H4 1.0800 2.1120 1.8857 2.2432
H5 1.9191 0.9606 2.8449 2.2432
Maximum atom distance is 2.8449Å 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 110.116 O2 C1 H3 113.977
O2 C1 H4 119.161 H3 C1 H4 121.946

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