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Geometry for NHCl2 (dichloroamine) 1A' CS

1910171554
1S/Cl2HN/c1-3-2/h3H INChIKey=JSYGRUBHOCKMGQ-UHFFFAOYSA-N

B3PW91/3-21G


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
N1 0.0240 0.8916 0.0000   0.0838 0.8877 0.0240
H2 -0.9826 1.1859 0.0000   0.1114 1.1807 -0.9826
Cl3 0.0240 -0.2184 1.5270   1.4997 -0.3610 0.0240
Cl4 0.0240 -0.2184 -1.5270   -1.5407 -0.0740 0.0240
Atom - Atom Distances (Å)
  N1 H2 Cl3 Cl4
N1 1.0487 1.8878 1.8878
H2 1.0487 2.3059 2.3059
Cl3 1.8878 2.3059 3.0539
Cl4 1.8878 2.3059 3.0539
Maximum atom distance is 3.0539Å between atoms Cl3 and Cl4.
picture of dichloroamine
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
Cl3 N1 Cl4 107.968
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
H2 N1 Cl3 99.499 H2 N1 Cl4 99.499

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