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Geometry for H2CN (Dihydrogen cyanide radical) 2B2 C2V

1910171554
InChI=1S/CH2N/c1-2/h1H2 INChIKey=PZIDJKOIMRBQLL-UHFFFAOYSA-N

B3LYP/LANL2DZ


Point group is C2v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0000 0.0000 -0.5187   -0.5187 0.0000 0.0000
N2 0.0000 0.0000 0.7584   0.7584 0.0000 0.0000
H3 0.0000 0.9345 -1.0981   -1.0981 0.9345 0.0000
H4 0.0000 -0.9345 -1.0981   -1.0981 -0.9345 0.0000
Atom - Atom Distances (Å)
  C1 N2 H3 H4
C1 1.2771 1.0995 1.0995
N2 1.2771 2.0784 2.0784
H3 1.0995 2.0784 1.8689
H4 1.0995 2.0784 1.8689
Maximum atom distance is 2.0784Å between atoms N2 and H3.
picture of Dihydrogen cyanide radical
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
N2 C1 H3 121.799 N2 C1 H4 121.799
H3 C1 H4 116.402

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