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Geometry for CH2NH (Methanimine) 1A' CS

1910171554
InChI=1S/CH3N/c1-2/h2H,1H2 INChIKey=WDWDWGRYHDPSDS-UHFFFAOYSA-N

B3LYP/CEP-121G


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0742 0.5860 0.0000   0.5793 0.1154 0.0000
N2 0.0742 -0.7117 0.0000   -0.7152 0.0237 0.0000
H3 -0.8228 1.2239 0.0000   1.2789 -0.7343 0.0000
H4 1.0368 1.1019 0.0000   1.0260 1.1120 0.0000
H5 -0.8814 -1.1114 0.0000   -1.0464 -0.9577 0.0000
Atom - Atom Distances (Å)
  C1 N2 H3 H4 H5
C1 1.2977 1.1006 1.0921 1.9479
N2 1.2977 2.1333 2.0533 1.0358
H3 1.1006 2.1333 1.8636 2.3360
H4 1.0921 2.0533 1.8636 2.9289
H5 1.9479 1.0358 2.3360 2.9289
Maximum atom distance is 2.9289Å between atoms H4 and H5.
picture of Methanimine
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 N2 H5 112.698 N2 C1 H3 125.417
N2 C1 H4 118.188 H3 C1 H4 116.395

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