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Geometry for CH7N3 (triaminomethane) 1A C3

1910171554
InChI=1S/CH7N3/c2-1(3)4/h1H,2-4H2 INChIKey=

wB97X-D/6-31+G**


Point group is C3
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0000 0.0000 0.3654   0.0000 0.0000 0.3654
H2 0.0000 0.0000 1.4608   0.0000 0.0000 1.4608
N3 0.0000 1.3934 -0.0553   1.2540 0.6075 -0.0553
N4 1.2067 -0.6967 -0.0553   -1.1531 0.7823 -0.0553
N5 -1.2067 -0.6967 -0.0553   -0.1009 -1.3898 -0.0553
H6 0.8613 1.8455 0.2370   1.2854 1.5797 0.2370
H7 1.1676 -1.6687 0.2370   -2.0108 0.3233 0.2370
H8 -2.0289 -0.1769 0.2370   0.7254 -1.9031 0.2370
H9 -0.0615 1.4656 -1.0679   1.3458 0.5837 -1.0679
H10 1.3000 -0.6796 -1.0679   -1.1784 0.8737 -1.0679
H11 -1.2385 -0.7860 -1.0679   -0.1674 -1.4573 -1.0679
Atom - Atom Distances (Å)
  C1 H2 N3 N4 N5 H6 H7 H8 H9 H10 H11
C1 1.0955 1.4555 1.4555 1.4555 2.0407 2.0407 2.0407 2.0509 2.0509 2.0509
H2 1.0955 2.0592 2.0592 2.0592 2.3761 2.3761 2.3761 2.9234 2.9234 2.9234
N3 1.4555 2.0592 2.4135 2.4135 1.0157 3.2902 2.5822 1.0170 2.6482 2.7036
N4 1.4555 2.0592 2.4135 2.4135 2.5822 1.0157 3.2902 2.7036 1.0170 2.6482
N5 1.4555 2.0592 2.4135 2.4135 3.2902 2.5822 1.0157 2.6482 2.7036 1.0170
H6 2.0407 2.3761 1.0157 2.5822 3.2902 3.5275 3.5275 1.6427 2.8760 3.6107
H7 2.0407 2.3761 3.2902 1.0157 2.5822 3.5275 3.5275 3.6107 1.6427 2.8760
H8 2.0407 2.3761 2.5822 3.2902 1.0157 3.5275 3.5275 2.8760 3.6107 1.6427
H9 2.0509 2.9234 1.0170 2.7036 2.6482 1.6427 3.6107 2.8760 2.5408 2.5408
H10 2.0509 2.9234 2.6482 1.0170 2.7036 2.8760 1.6427 3.6107 2.5408 2.5408
H11 2.0509 2.9234 2.7036 2.6482 1.0170 3.6107 2.8760 1.6427 2.5408 2.5408
Maximum atom distance is 3.6107Å between atoms H7 and H9.
picture of triaminomethane
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
N3 C1 N4 112.008 N3 C1 N5 112.008
N4 C1 N5 112.008
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 N3 H6 110.060 C1 N3 H9 110.836
C1 N4 H7 110.060 C1 N4 H10 110.836
C1 N5 H8 110.060 C1 N5 H11 110.836
H2 C1 N3 106.797 H2 C1 N4 106.797
H2 C1 N5 106.797 H6 N3 H9 107.823
H7 N4 H10 107.823 H8 N5 H11 107.823

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