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Geometry for CH3NH2 (methyl amine) 1A' CS

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

MP3/TZVP


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0503 0.7045 0.0000   -0.0029 0.0502 0.7045
N2 0.0503 -0.7578 0.0000   -0.0029 0.0502 -0.7578
H3 -0.9439 1.1644 0.0000   0.0547 -0.9423 1.1644
H4 0.5872 1.0621 0.8774   0.8419 0.6371 1.0621
H5 0.5872 1.0621 -0.8774   -0.9099 0.5354 1.0621
H6 -0.4419 -1.1057 -0.8104   -0.7835 -0.4881 -1.1057
H7 -0.4419 -1.1057 0.8104   0.8347 -0.3942 -1.1057
Atom - Atom Distances (Å)
  C1 N2 H3 H4 H5 H6 H7
C1 1.4623 1.0954 1.0890 1.0890 2.0435 2.0435
N2 1.4623 2.1641 2.0904 2.0904 1.0099 1.0099
H3 1.0954 2.1641 1.7677 1.7677 2.4621 2.4621
H4 1.0890 2.0904 1.7677 1.7547 2.9337 2.4005
H5 1.0890 2.0904 1.7677 1.7547 2.4005 2.9337
H6 2.0435 1.0099 2.4621 2.9337 2.4005 1.6208
H7 2.0435 1.0099 2.4621 2.4005 2.9337 1.6208
Maximum atom distance is 2.9337Å 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 110.148 C1 N2 H7 110.148
N2 C1 H3 114.823 N2 C1 H4 109.166
N2 C1 H5 109.166 H3 C1 H4 108.041
H3 C1 H5 108.041 H4 C1 H5 107.349
H6 N2 H7 106.726

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