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Geometry for CH3NHCH3 (Dimethylamine) 1A' CS

1910171554
InChI=1S/C2H7N/c1-3-2/h3H,1-2H3 INChIKey=ROSDSFDQCJNGOL-UHFFFAOYSA-N

mPW1PW91/aug-cc-pVDZ


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
N1 0.0266 0.5792 0.0000   0.0643 0.5756 0.0266
H2 -0.7771 1.1970 0.0000   0.1329 1.1896 -0.7771
C3 0.0266 -0.2207 1.2089   1.1769 -0.3535 0.0266
C4 0.0266 -0.2207 -1.2089   -1.2259 -0.0851 0.0266
H5 -0.8056 -0.9500 1.2673   1.1540 -1.0848 -0.8056
H6 -0.8056 -0.9500 -1.2673   -1.3649 -0.8034 -0.8056
H7 0.9669 -0.7854 1.2704   1.1754 -0.9216 0.9669
H8 0.9669 -0.7854 -1.2704   -1.3498 -0.6394 0.9669
H9 -0.0252 0.4337 2.0873   2.1226 0.1993 -0.0252
H10 -0.0252 0.4337 -2.0873   -2.0263 0.6628 -0.0252
Atom - Atom Distances (Å)
  N1 H2 C3 C4 H5 H6 H7 H8 H9 H10
N1 1.0137 1.4496 1.4496 2.1533 2.1533 2.0881 2.0881 2.0930 2.0930
H2 1.0137 2.0291 2.0291 2.4932 2.4932 2.9300 2.9300 2.3463 2.3463
C3 1.4496 2.0291 2.4178 1.1081 2.7122 1.0985 2.7111 1.0966 3.3610
C4 1.4496 2.0291 2.4178 2.7122 1.1081 2.7111 1.0985 3.3610 1.0966
H5 2.1533 2.4932 1.1081 2.7122 2.5345 1.7801 3.0998 1.7878 3.7117
H6 2.1533 2.4932 2.7122 1.1081 2.5345 3.0998 1.7801 3.7117 1.7878
H7 2.0881 2.9300 1.0985 2.7111 1.7801 3.0998 2.5409 1.7713 3.7074
H8 2.0881 2.9300 2.7111 1.0985 3.0998 1.7801 2.5409 3.7074 1.7713
H9 2.0930 2.3463 1.0966 3.3610 1.7878 3.7117 1.7713 3.7074 4.1746
H10 2.0930 2.3463 3.3610 1.0966 3.7117 1.7878 3.7074 1.7713 4.1746
Maximum atom distance is 4.1746Å between atoms H9 and H10.
picture of Dimethylamine
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C3 N1 C4 113.018
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
N1 C3 H5 114.022 N1 C3 H7 109.289
N1 C3 H9 109.800 N1 C4 H6 114.022
N1 C4 H8 109.289 N1 C4 H10 109.800
H2 N1 C3 109.650 H2 N1 C4 109.650
H5 C3 H7 107.554 H5 C3 H9 108.370
H6 C4 H8 107.554 H6 C4 H10 108.370
H7 C3 H9 107.595 H8 C4 H10 107.595

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