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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

HF/CEP-31G*


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0000 0.5615 0.0000   0.5514 0.1058 0.0000
O2 1.1660 0.8434 0.0000   0.6085 1.3041 0.0000
O3 -0.9664 1.4901 0.0000   1.6455 -0.6683 0.0000
C4 -0.5757 -0.8578 0.0000   -0.7340 -0.7270 0.0000
N5 0.4143 -1.9204 0.0000   -1.9641 0.0449 0.0000
H6 -0.5494 2.3498 0.0000   2.4113 -0.0967 0.0000
H7 -1.2210 -0.9480 0.8728   -0.7008 -1.3778 0.8728
H8 -1.2210 -0.9480 -0.8728   -0.7008 -1.3778 -0.8728
H9 1.0126 -1.8336 0.8042   -1.9916 0.6488 0.8042
H10 1.0126 -1.8336 -0.8042   -1.9916 0.6488 -0.8042
Atom - Atom Distances (Å)
  C1 O2 O3 C4 N5 H6 H7 H8 H9 H10
C1 1.1996 1.3403 1.5316 2.5162 1.8709 2.1286 2.1286 2.7218 2.7218
O2 1.1996 2.2284 2.4347 2.8642 2.2830 3.1095 3.1095 2.7994 2.7994
O3 1.3403 2.2284 2.3802 3.6793 0.9556 2.6020 2.6020 3.9509 3.9509
C4 1.5316 2.4347 2.3802 1.4522 3.2078 1.0892 1.0892 2.0301 2.0301
N5 2.5162 2.8642 3.6793 1.4522 4.3776 2.0932 2.0932 1.0061 1.0061
H6 1.8709 2.2830 0.9556 3.2078 4.3776 3.4768 3.4768 4.5374 4.5374
H7 2.1286 3.1095 2.6020 1.0892 2.0932 3.4768 1.7456 2.4037 2.9301
H8 2.1286 3.1095 2.6020 1.0892 2.0932 3.4768 1.7456 2.9301 2.4037
H9 2.7218 2.7994 3.9509 2.0301 1.0061 4.5374 2.4037 2.9301 1.6083
H10 2.7218 2.7994 3.9509 2.0301 1.0061 4.5374 2.9301 2.4037 1.6083
Maximum atom distance is 4.5374Å 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 114.949 O2 C1 O3 122.552
O2 C1 C4 125.669 O3 C1 C4 111.778
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 O3 H6 107.981 C1 C4 H7 107.419
C1 C4 H8 107.419 C4 N5 H9 110.015
C4 N5 H10 110.015 N5 C4 H7 110.081
N5 C4 H8 110.081 H7 C4 H8 106.511
H9 N5 H10 106.129

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