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Geometry for NaOCH3 (Sodium methoxide) 1A1 C3V

1910171554
InChI=1S/CH3O.Na/c1-2;/h1H3;/q-1;+1 INChIKey=WQDUMFSSJAZKTM-UHFFFAOYSA-N

M06-2X/6-311G**


Point group is C3v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
Na1 0.0000 0.0000 1.6585   1.6585 0.0000 0.0000
O2 0.0000 0.0000 -0.2719   -0.2719 0.0000 0.0000
C3 0.0000 0.0000 -1.6387   -1.6387 0.0000 0.0000
H4 0.0000 1.0181 -2.0786   -2.0786 0.3781 0.9453
H5 0.8817 -0.5090 -2.0786   -2.0786 0.6296 -0.8001
H6 -0.8817 -0.5090 -2.0786   -2.0786 -1.0077 -0.1452
Atom - Atom Distances (Å)
  Na1 O2 C3 H4 H5 H6
Na1 1.9304 3.2972 3.8733 3.8733 3.8733
O2 1.9304 1.3668 2.0738 2.0738 2.0738
C3 3.2972 1.3668 1.1091 1.1091 1.1091
H4 3.8733 2.0738 1.1091 1.7634 1.7634
H5 3.8733 2.0738 1.1091 1.7634 1.7634
H6 3.8733 2.0738 1.1091 1.7634 1.7634
Maximum atom distance is 3.8733Å between atoms Na1 and H5.
picture of Sodium methoxide
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
Na1 O2 C3 180.000
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
O2 C3 H4 113.369 O2 C3 H5 113.369
O2 C3 H6 113.369 H4 C3 H5 105.307
H4 C3 H6 105.307 H5 C3 H6 105.307

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