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Geometry for HOCHNH (hydroxymethylimine) 1A' CS OH down

1910171554
InChI=1S/CH3NO/c2-1-3/h1H,(H2,2,3) INChIKey=ZHNUHDYFZUAESO-UHFFFAOYSA-N

MP2=FULL/cc-pVDZ


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0000 0.4200 0.0000   0.0689 0.4143 0.0000
O2 -1.1201 -0.3313 0.0000   -1.1593 -0.1430 0.0000
N3 1.1644 -0.1070 0.0000   1.1311 -0.2967 0.0000
H4 -0.2601 1.4897 0.0000   -0.0120 1.5122 0.0000
H5 -0.7961 -1.2501 0.0000   -0.9905 -1.1025 0.0000
H6 1.8661 0.6400 0.0000   1.9459 0.3250 0.0000
Atom - Atom Distances (Å)
  C1 O2 N3 H4 H5 H6
C1 1.3487 1.2781 1.1009 1.8501 1.8791
O2 1.3487 2.2956 2.0139 0.9743 3.1403
N3 1.2781 2.2956 2.1398 2.2695 1.0249
H4 1.1009 2.0139 2.1398 2.7918 2.2897
H5 1.8501 0.9743 2.2695 2.7918 3.2650
H6 1.8791 3.1403 1.0249 2.2897 3.2650
Maximum atom distance is 3.2650Å between atoms H5 and H6.
picture of hydroxymethylimine
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
O2 C1 N3 121.801
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 O2 H5 104.427 C1 N3 H6 108.862
O2 C1 H4 110.187 N3 C1 H4 128.013

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