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Geometry for NH2Cl (chloramine) 1A' CS

1910171554
InChI=1S/ClH2N/c1-2/h2H2 INChIKey=QDHHCQZDFGDHMP-UHFFFAOYSA-N

B3PW91/6-311G*


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
N1 -0.0429 1.1346 0.0000   0.0021 -0.0429 1.1346
Cl2 -0.0429 -0.6301 0.0000   0.0021 -0.0429 -0.6301
H3 0.5152 1.3846 0.8128   0.7865 0.5544 1.3846
H4 0.5152 1.3846 -0.8128   -0.8370 0.4747 1.3846
Atom - Atom Distances (Å)
  N1 Cl2 H3 H4
N1 1.7648 1.0171 1.0171
Cl2 1.7648 2.2430 2.2430
H3 1.0171 2.2430 1.6255
H4 1.0171 2.2430 1.6255
Maximum atom distance is 2.2430Å between atoms Cl2 and H3.
picture of chloramine
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
Cl2 N1 H3 104.228 Cl2 N1 H4 104.228
H3 N1 H4 106.080

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