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Geometry for CH3NH2 (methyl amine) 1A' CS

1910171554
InChI=1S/CH5N/c1-2/h2H2,1H3 INChIKey=BAVYZALUXZFZLV-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 0.0367 0.7205 0.0000   0.7214 0.0000 0.0047
N2 0.0367 -0.7582 0.0000   -0.7558 0.0000 0.0702
H3 -0.9670 1.1891 0.0000   1.1451 0.0000 -1.0187
H4 0.5783 1.0840 0.8826   1.1086 0.8826 0.5297
H5 0.5783 1.0840 -0.8826   1.1086 -0.8826 0.5297
H6 -0.3332 -1.1865 -0.8433   -1.2001 -0.8433 -0.2803
H7 -0.3332 -1.1865 0.8433   -1.2001 0.8433 -0.2803
Atom - Atom Distances (Å)
  C1 N2 H3 H4 H5 H6 H7
C1 1.4787 1.1076 1.0975 1.0975 2.1177 2.1177
N2 1.4787 2.1907 2.1133 2.1133 1.0156 1.0156
H3 1.1076 2.1907 1.7827 1.7827 2.5993 2.5993
H4 1.0975 2.1133 1.7827 1.7651 2.9941 2.4470
H5 1.0975 2.1133 1.7827 1.7651 2.4470 2.9941
H6 2.1177 1.0156 2.5993 2.9941 2.4470 1.6866
H7 2.1177 1.0156 2.5993 2.4470 2.9941 1.6866
Maximum atom distance is 2.9941Å between atoms H4 and H6.
picture of methyl amine
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 H6 114.945 C1 N2 H7 114.945
N2 C1 H3 115.027 N2 C1 H4 109.345
N2 C1 H5 109.345 H3 C1 H4 107.882
H3 C1 H5 107.882 H4 C1 H5 107.062
H6 N2 H7 112.271

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