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Geometry for ClONO2 (Chlorine nitrate) 1A' CS

1910171554
InChI=1S/ClNO3/c1-5-2(3)4 INChIKey=XYLGPCWDPLOBGP-UHFFFAOYSA-N

M06-2X/6-31G**


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
Cl1 -1.6053 0.3047 0.0000   -1.6339 -0.0185 0.0000
O2 0.0000 0.8154 0.0000   -0.1611 0.7993 0.0000
N3 0.9491 -0.2756 0.0000   0.9848 -0.0826 0.0000
O4 0.5257 -1.3865 0.0000   0.7892 -1.2553 0.0000
O5 2.0552 0.1648 0.0000   1.9821 0.5675 0.0000
Atom - Atom Distances (Å)
  Cl1 O2 N3 O4 O5
Cl1 1.6846 2.6195 2.7205 3.6631
O2 1.6846 1.4460 2.2638 2.1557
N3 2.6195 1.4460 1.1889 1.1905
O4 2.7205 2.2638 1.1889 2.1785
O5 3.6631 2.1557 1.1905 2.1785
Maximum atom distance is 3.6631Å between atoms Cl1 and O5.
picture of Chlorine nitrate
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
Cl1 O2 N3 113.372 O2 N3 O4 118.116
O2 N3 O5 109.314 O4 N3 O5 132.570

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