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Geometry for CH3NH2 (methyl amine) 1A' CS

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

HF/cc-pVDZ


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0511 0.6985 0.0000   -0.0027 0.0510 0.6985
N2 0.0511 -0.7540 0.0000   -0.0027 0.0510 -0.7540
H3 -0.9447 1.1622 0.0000   0.0507 -0.9434 1.1622
H4 0.5876 1.0620 0.8786   0.8458 0.6338 1.0620
H5 0.5876 1.0620 -0.8786   -0.9088 0.5396 1.0620
H6 -0.4471 -1.0994 -0.8029   -0.7778 -0.4895 -1.0994
H7 -0.4471 -1.0994 0.8029   0.8257 -0.4034 -1.0994
Atom - Atom Distances (Å)
  C1 N2 H3 H4 H5 H6 H7
C1 1.4525 1.0985 1.0917 1.0917 2.0310 2.0310
N2 1.4525 2.1595 2.0875 2.0875 1.0060 1.0060
H3 1.0985 2.1595 1.7692 1.7692 2.4509 2.4509
H4 1.0917 2.0875 1.7692 1.7571 2.9274 2.3974
H5 1.0917 2.0875 1.7692 1.7571 2.3974 2.9274
H6 2.0310 1.0060 2.4509 2.9274 2.3974 1.6058
H7 2.0310 1.0060 2.4509 2.3974 2.9274 1.6058
Maximum atom distance is 2.9274Å 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 110.076 C1 N2 H7 110.076
N2 C1 H3 114.970 N2 C1 H4 109.451
N2 C1 H5 109.451 H3 C1 H4 107.754
H3 C1 H5 107.754 H4 C1 H5 107.171
H6 N2 H7 105.897

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