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Geometry for NHCl2 (dichloroamine) 1A' CS

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

MP4=FULL/cc-pVTZ


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
N1 0.0229 0.8170 0.0000   0.0000 0.8117 0.0958
H2 -0.9375 1.1613 0.0000   0.0000 1.2404 -0.8300
Cl3 0.0229 -0.2024 1.4415   1.4415 -0.2036 0.0047
Cl4 0.0229 -0.2024 -1.4415   -1.4415 -0.2036 0.0047
Atom - Atom Distances (Å)
  N1 H2 Cl3 Cl4
N1 1.0202 1.7655 1.7655
H2 1.0202 2.2045 2.2045
Cl3 1.7655 2.2045 2.8830
Cl4 1.7655 2.2045 2.8830
Maximum atom distance is 2.8830Å 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 109.465
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
H2 N1 Cl3 101.236 H2 N1 Cl4 101.236

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