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Geometry for NHCHNH2 (aminomethanimine) 1A C1

1910171554
InChI=1S/CH4N2/c2-1-3/h1H,(H3,2,3) INChIKey=PNKUSGQVOMIXLU-UHFFFAOYSA-N

CCD/cc-pVDZ


Point group is C1
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 -0.1272 0.3977 -0.0051   0.1401 0.3934 -0.0038
N2 1.1544 -0.1431 -0.0971   -1.1567 -0.1058 -0.1153
N3 -1.1715 -0.3416 0.0212   1.1593 -0.3793 0.0407
H4 -0.1301 1.5045 -0.0203   0.1792 1.4994 -0.0212
H5 1.8554 0.3727 0.4290   -1.8489 0.4338 0.3985
H6 1.1599 -1.1328 0.1460   -1.1982 -1.0943 0.1297
H7 -2.0017 0.2615 0.0066   2.0088 0.1964 0.0381
Atom - Atom Distances (Å)
  C1 N2 N3 H4 H5 H6 H7
C1 1.3941 1.2798 1.1069 2.0298 2.0055 1.8795
N2 1.3941 2.3373 2.0905 1.0170 1.0192 3.1836
N3 1.2798 2.3373 2.1200 3.1367 2.4652 1.0262
H4 1.1069 2.0905 2.1200 2.3292 2.9406 2.2470
H5 2.0298 1.0170 3.1367 2.3292 1.6824 3.8818
H6 2.0055 1.0192 2.4652 2.9406 1.6824 3.4582
H7 1.8795 3.1836 1.0262 2.2470 3.8818 3.4582
Maximum atom distance is 3.8818Å between atoms H5 and H7.
picture of aminomethanimine
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
N2 C1 N3 121.832
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 N2 H5 113.756 C1 N2 H6 111.466
C1 N3 H7 108.688 N2 C1 H4 112.916
N3 C1 H4 125.154 H5 N2 H6 111.435

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