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Geometry for HOCHNH (hydroxymethylimine) 1A' CS H all up

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

B97D3/aug-cc-pVDZ


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0000 0.3824 0.0000   0.0944 0.3705 0.0000
O2 -1.0106 -0.5383 0.0000   -1.1123 -0.2720 0.0000
N3 1.2073 -0.0200 0.0000   1.1650 -0.3175 0.0000
H4 -0.3450 1.4346 0.0000   0.0199 1.4754 0.0000
H5 -1.8590 -0.0700 0.0000   -1.8187 0.3913 0.0000
H6 1.8380 0.7873 0.0000   1.9755 0.3090 0.0000
Atom - Atom Distances (Å)
  C1 O2 N3 H4 H5 H6
C1 1.3671 1.2726 1.1074 1.9132 1.8821
O2 1.3671 2.2777 2.0822 0.9690 3.1419
N3 1.2726 2.2777 2.1273 3.0667 1.0244
H4 1.1074 2.0822 2.1273 2.1344 2.2770
H5 1.9132 0.9690 3.0667 2.1344 3.7951
H6 1.8821 3.1419 1.0244 2.2770 3.7951
Maximum atom distance is 3.7951Å 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 119.236
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 O2 H5 108.767 C1 N3 H6 109.571
O2 C1 H4 114.178 N3 C1 H4 126.586

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