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Geometry for CH3NH2 (methyl amine) 1A' CS

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

MP2=FULL/6-31+G**


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0484 0.7066 0.0000   -0.0028 0.0483 0.7066
N2 0.0484 -0.7555 0.0000   -0.0028 0.0483 -0.7555
H3 -0.9427 1.1696 0.0000   0.0545 -0.9412 1.1696
H4 0.5863 1.0573 0.8774   0.8420 0.6361 1.0573
H5 0.5863 1.0573 -0.8774   -0.9098 0.5346 1.0573
H6 -0.4295 -1.1177 -0.8151   -0.7889 -0.4759 -1.1177
H7 -0.4295 -1.1177 0.8151   0.8385 -0.3816 -1.1177
Atom - Atom Distances (Å)
  C1 N2 H3 H4 H5 H6 H7
C1 1.4620 1.0940 1.0873 1.0873 2.0545 2.0545
N2 1.4620 2.1652 2.0845 2.0845 1.0119 1.0119
H3 1.0940 2.1652 1.7665 1.7665 2.4819 2.4819
H4 1.0873 2.0845 1.7665 1.7547 2.9372 2.4013
H5 1.0873 2.0845 1.7665 1.7547 2.4013 2.9372
H6 2.0545 1.0119 2.4819 2.9372 2.4013 1.6301
H7 2.0545 1.0119 2.4819 2.4013 2.9372 1.6301
Maximum atom distance is 2.9372Å 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 110.979 C1 N2 H7 110.979
N2 C1 H3 115.042 N2 C1 H4 108.817
N2 C1 H5 108.817 H3 C1 H4 108.162
H3 C1 H5 108.162 H4 C1 H5 107.600
H6 N2 H7 107.314

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