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Geometry for CH3NH2 (methyl amine) 1A' CS

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

mPW1PW91/6-31+G**


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0478 0.7025 0.0000   0.7041 0.0000 0.0080
N2 0.0478 -0.7533 0.0000   -0.7494 0.0000 0.0903
H3 -0.9467 1.1743 0.0000   1.1189 0.0000 -1.0115
H4 0.5891 1.0619 0.8787   1.0935 0.8787 0.5282
H5 0.5891 1.0619 -0.8787   1.0935 -0.8787 0.5282
H6 -0.4264 -1.1200 -0.8158   -1.1423 -0.8158 -0.3624
H7 -0.4264 -1.1200 0.8158   -1.1423 0.8158 -0.3624
Atom - Atom Distances (Å)
  C1 N2 H3 H4 H5 H6 H7
C1 1.4557 1.1007 1.0929 1.0929 2.0522 2.0522
N2 1.4557 2.1690 2.0880 2.0880 1.0123 1.0123
H3 1.1007 2.1690 1.7730 1.7730 2.4899 2.4899
H4 1.0929 2.0880 1.7730 1.7574 2.9433 2.4074
H5 1.0929 2.0880 1.7730 1.7574 2.4074 2.9433
H6 2.0522 1.0123 2.4899 2.9433 2.4074 1.6315
H7 2.0522 1.0123 2.4899 2.4074 2.9433 1.6315
Maximum atom distance is 2.9433Å 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 111.239 C1 N2 H7 111.239
N2 C1 H3 115.382 N2 C1 H4 109.199
N2 C1 H5 109.199 H3 C1 H4 107.853
H3 C1 H5 107.853 H4 C1 H5 107.036
H6 N2 H7 107.379

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