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Geometry for CH3NHCH3 (Dimethylamine) 1A' CS

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

B3LYP/Def2TZVPP


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
N1 0.0262 0.5761 0.0000   0.0702 0.5718 0.0262
H2 -0.7611 1.2106 0.0000   0.1475 1.2015 -0.7611
C3 0.0262 -0.2208 1.2165   1.1806 -0.3674 0.0262
C4 0.0262 -0.2208 -1.2165   -1.2344 -0.0709 0.0262
H5 -0.8098 -0.9353 1.2855   1.1619 -1.0850 -0.8098
H6 -0.8098 -0.9353 -1.2855   -1.3899 -0.7716 -0.8098
H7 0.9531 -0.7951 1.2761   1.1697 -0.9447 0.9531
H8 0.9531 -0.7951 -1.2761   -1.3635 -0.6337 0.9531
H9 -0.0117 0.4336 2.0878   2.1251 0.1760 -0.0117
H10 -0.0117 0.4336 -2.0878   -2.0194 0.6848 -0.0117
Atom - Atom Distances (Å)
  N1 H2 C3 C4 H5 H6 H7 H8 H9 H10
N1 1.0111 1.4543 1.4543 2.1530 2.1530 2.0899 2.0899 2.0930 2.0930
H2 1.0111 2.0368 2.0368 2.5019 2.5019 2.9308 2.9308 2.3503 2.3503
C3 1.4543 2.0368 2.4331 1.1019 2.7330 1.0921 2.7208 1.0903 3.3687
C4 1.4543 2.0368 2.4331 2.7330 1.1019 2.7208 1.0921 3.3687 1.0903
H5 2.1530 2.5019 1.1019 2.7330 2.5709 1.7685 3.1128 1.7761 3.7269
H6 2.1530 2.5019 2.7330 1.1019 2.5709 3.1128 1.7685 3.7269 1.7761
H7 2.0899 2.9308 1.0921 2.7208 1.7685 3.1128 2.5523 1.7605 3.7090
H8 2.0899 2.9308 2.7208 1.0921 3.1128 1.7685 2.5523 3.7090 1.7605
H9 2.0930 2.3503 1.0903 3.3687 1.7761 3.7269 1.7605 3.7090 4.1756
H10 2.0930 2.3503 3.3687 1.0903 3.7269 1.7761 3.7090 1.7605 4.1756
Maximum atom distance is 4.1756Å 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 113.550
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
N1 C3 H5 114.056 N1 C3 H7 109.501
N1 C3 H9 109.852 N1 C4 H6 114.056
N1 C4 H8 109.501 N1 C4 H10 109.852
H2 N1 C3 110.111 H2 N1 C4 110.111
H5 C3 H7 107.430 H5 C3 H9 108.230
H6 C4 H8 107.430 H6 C4 H10 108.230
H7 C3 H9 107.550 H8 C4 H10 107.550

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