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Geometry for CH3NH2 (methyl amine) 1A' CS

1910171554
InChI=1S/CH5N/c1-2/h2H2,1H3 INChIKey=BAVYZALUXZFZLV-UHFFFAOYSA-N

PBEPBE/6-31G(2df,p)


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0534 0.7034 0.0000   0.7054 0.0000 0.0105
N2 0.0534 -0.7648 0.0000   -0.7601 0.0000 0.0999
H3 -0.9443 1.1933 0.0000   1.1336 0.0000 -1.0152
H4 0.6002 1.0661 0.8864   1.1007 0.8864 0.5341
H5 0.6002 1.0661 -0.8864   1.1007 -0.8864 0.5341
H6 -0.4752 -1.0963 -0.8118   -1.1232 -0.8118 -0.4076
H7 -0.4752 -1.0963 0.8118   -1.1232 0.8118 -0.4076
Atom - Atom Distances (Å)
  C1 N2 H3 H4 H5 H6 H7
C1 1.4682 1.1115 1.1028 1.1028 2.0439 2.0439
N2 1.4682 2.1976 2.1064 2.1064 1.0239 1.0239
H3 1.1115 2.1976 1.7853 1.7853 2.4741 2.4741
H4 1.1028 2.1064 1.7853 1.7728 2.9524 2.4162
H5 1.1028 2.1064 1.7853 1.7728 2.4162 2.9524
H6 2.0439 1.0239 2.4741 2.9524 2.4162 1.6236
H7 2.0439 1.0239 2.4741 2.4162 2.9524 1.6236
Maximum atom distance is 2.9524Å 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 108.890 C1 N2 H7 108.890
N2 C1 H3 116.153 N2 C1 H4 109.201
N2 C1 H5 109.201 H3 C1 H4 107.460
H3 C1 H5 107.460 H4 C1 H5 106.983
H6 N2 H7 104.906

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