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Geometry for CHONH2 (formamide) 1A Non-Planar

1910171554
InChI=1S/CH3NO/c2-1-3/h1H,(H2,2,3) INChIKey=ZHNUHDYFZUAESO-UHFFFAOYSA-N

B3LYP/TZVP


Point group is C1
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 -0.1622 0.3859 -0.0000   -0.1701 -0.3825 -0.0001
O2 -1.1954 -0.2457 0.0000   -1.1901 0.2702 -0.0000
N3 1.0831 -0.1572 -0.0002   1.0861 0.1349 -0.0002
H4 -0.1386 1.4910 0.0003   -0.1692 -1.4878 0.0003
H5 1.1867 -1.1600 0.0007   1.2102 1.1353 0.0007
H6 1.9065 0.4199 0.0005   1.8975 -0.4589 0.0005
Atom - Atom Distances (Å)
  C1 O2 N3 H4 H5 H6
C1 1.2109 1.3585 1.1053 2.0516 2.0690
O2 1.2109 2.2801 2.0330 2.5514 3.1725
N3 1.3585 2.2801 2.0515 1.0081 1.0055
H4 1.1053 2.0330 2.0515 2.9637 2.3086
H5 2.0516 2.5514 1.0081 2.9637 1.7361
H6 2.0690 3.1725 1.0055 2.3086 1.7361
Maximum atom distance is 3.1725Å between atoms O2 and H6.
picture of formamide
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
O2 C1 N3 124.998
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 N3 H5 119.461 C1 N3 H6 121.417
O2 C1 H4 122.664 N3 C1 H4 112.338
H5 N3 H6 119.122

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