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Geometry for H2NCH2COOH (Glycine) 1A' CS

1910171554
InChI=1S/C2H5NO2/c3-1-2(4)5/h1,3H2,(H,4,5) INChIKey=DHMQDGOQFOQNFH-UHFFFAOYSA-N

HSEh1PBE/6-31G*


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0000 0.5486 0.0000   0.5379 -0.1075 0.0000
O2 1.1792 0.8092 0.0000   1.0246 0.9978 0.0000
O3 -0.9612 1.4912 0.0000   1.2740 -1.2347 0.0000
C4 -0.5820 -0.8522 0.0000   -0.9498 -0.4038 0.0000
N5 0.3901 -1.9176 0.0000   -1.8040 0.7583 0.0000
H6 -0.5015 2.3486 0.0000   2.2048 -0.9520 0.0000
H7 -1.2410 -0.9440 0.8723   -1.1689 -1.0319 0.8723
H8 -1.2410 -0.9440 -0.8723   -1.1689 -1.0319 -0.8723
H9 1.0003 -1.8093 0.8060   -1.5782 1.3354 0.8060
H10 1.0003 -1.8093 -0.8060   -1.5782 1.3354 -0.8060
Atom - Atom Distances (Å)
  C1 O2 O3 C4 N5 H6 H7 H8 H9 H10
C1 1.2077 1.3463 1.5169 2.4968 1.8685 2.1281 2.1281 2.6851 2.6851
O2 1.2077 2.2464 2.4212 2.8387 2.2791 3.1132 3.1132 2.7456 2.7456
O3 1.3463 2.2464 2.3739 3.6669 0.9728 2.6018 2.6018 3.9230 3.9230
C4 1.5169 2.4212 2.3739 1.4422 3.2018 1.0970 1.0970 2.0173 2.0173
N5 2.4968 2.8387 3.6669 1.4422 4.3583 2.0902 2.0902 1.0167 1.0167
H6 1.8685 2.2791 0.9728 3.2018 4.3583 3.4855 3.4855 4.4936 4.4936
H7 2.1281 3.1132 2.6018 1.0970 2.0902 3.4855 1.7445 2.4034 2.9306
H8 2.1281 3.1132 2.6018 1.0970 2.0902 3.4855 1.7445 2.9306 2.4034
H9 2.6851 2.7456 3.9230 2.0173 1.0167 4.4936 2.4034 2.9306 1.6120
H10 2.6851 2.7456 3.9230 2.0173 1.0167 4.4936 2.9306 2.4034 1.6120
Maximum atom distance is 4.4936Å between atoms H6 and H9.
picture of Glycine
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 C4 N5 115.057 O2 C1 O3 123.094
O2 C1 C4 125.026 O3 C1 C4 111.880
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 O3 H6 106.244 C1 C4 H7 107.923
C1 C4 H8 107.923 C4 N5 H9 109.018
C4 N5 H10 109.018 N5 C4 H7 110.064
N5 C4 H8 110.064 H7 C4 H8 105.332
H9 N5 H10 104.890

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