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Geometry for H2CNCN (cyanamide, methylene) 1A'

1910171554
InChI=1S/C2H2N2/c1-4-2-3/h1H2 INChIKey=

B1B95/STO-3G


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.1436 -1.5748 0.0000   -1.5422 0.3494 0.0000
N2 -0.6583 -0.5331 0.0000   -0.6150 -0.5825 0.0000
C3 0.0000 0.7220 0.0000   0.7157 -0.0949 0.0000
N4 0.4042 1.8512 0.0000   1.8882 0.1574 0.0000
H5 -0.3313 -2.5700 0.0000   -2.5912 0.0094 0.0000
H6 1.2486 -1.5396 0.0000   -1.3622 1.4401 0.0000
Atom - Atom Distances (Å)
  C1 N2 C3 N4 H5 H6
C1 1.3146 2.3013 3.4358 1.1027 1.1055
N2 1.3146 1.4173 2.6103 2.0629 2.1562
C3 2.3013 1.4173 1.1993 3.3086 2.5834
N4 3.4358 2.6103 1.1993 4.4819 3.4944
H5 1.1027 2.0629 3.3086 4.4819 1.8861
H6 1.1055 2.1562 2.5834 3.4944 1.8861
Maximum atom distance is 4.4819Å between atoms N4 and H5.
picture of cyanamide, methylene
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 N2 C3 114.731 N2 C3 N4 172.017
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
N2 C1 H5 116.899 N2 C1 H6 125.771
H5 C1 H6 117.330

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