2H3
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O4 | C4 | sing | 1.43Å | 1.37Å | |
| O5 | C5 | sing | 1.43Å | 1.36Å | |
| C5 | C4 | sing | 1.53Å | 1.50Å | |
| C5 | C6 | sing | 1.53Å | 1.49Å | |
| C4 | C3 | sing | 1.53Å | 1.50Å | |
| C3 | O3 | sing | 1.43Å | 1.38Å | |
| C3 | C2 | sing | 1.53Å | 1.49Å | |
| O6 | C6 | sing | 1.43Å | 1.36Å | |
| C6 | C1 | sing | 1.53Å | 1.49Å | |
| O2 | C2 | sing | 1.43Å | 1.37Å | |
| C1 | C2 | sing | 1.53Å | 1.63Å | |
| C1 | O1 | sing | 1.43Å | 1.37Å | |
| O3 | H1 | sing | 0.97Å | 0.95Å | |
| C3 | H2 | sing | 1.09Å | 1.10Å | |
| C4 | H3 | sing | 1.09Å | 1.10Å | |
| O4 | H4 | sing | 0.97Å | 0.95Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| O5 | H6 | sing | 0.97Å | 0.95Å | |
| C6 | H7 | sing | 1.09Å | 1.10Å | |
| O6 | H8 | sing | 0.97Å | 0.95Å | |
| C1 | H9 | sing | 1.09Å | 1.10Å | |
| O1 | H10 | sing | 0.97Å | 0.95Å | |
| C2 | H11 | sing | 1.09Å | 1.10Å | |
| O2 | H12 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O4 | C4 | C5 | 105.1° | 109.4° |
| O4 | C4 | C3 | 109.5° | 109.5° |
| O4 | C4 | H3 | 111.7° | 109.5° |
| C4 | O4 | H4 | 109.5° | 114.1° |
| O5 | C5 | C4 | 111.1° | 109.5° |
| O5 | C5 | C6 | 110.1° | 109.4° |
| O5 | C5 | H5 | 109.6° | 109.5° |
| C5 | O5 | H6 | 109.5° | 114.0° |
| C4 | C5 | C6 | 110.3° | 109.5° |
| C5 | C4 | C3 | 110.8° | 109.5° |
| C5 | C4 | H3 | 109.8° | 109.5° |
| C4 | C5 | H5 | 107.8° | 109.5° |
| C5 | C6 | O6 | 110.5° | 109.5° |
| C5 | C6 | C1 | 112.0° | 109.4° |
| C6 | C5 | H5 | 107.9° | 109.5° |
| C5 | C6 | H7 | 108.3° | 109.5° |
| C4 | C3 | O3 | 110.9° | 109.5° |
| C4 | C3 | C2 | 114.5° | 109.5° |
| C4 | C3 | H2 | 107.5° | 109.5° |
| C3 | C4 | H3 | 109.8° | 109.5° |
| O3 | C3 | C2 | 106.8° | 109.5° |
| C3 | O3 | H1 | 109.5° | 114.0° |
| O3 | C3 | H2 | 109.2° | 109.5° |
| C3 | C2 | O2 | 109.3° | 109.5° |
| C3 | C2 | C1 | 108.7° | 109.4° |
| C2 | C3 | H2 | 107.7° | 109.5° |
| C3 | C2 | H11 | 109.0° | 109.5° |
| O6 | C6 | C1 | 107.4° | 109.5° |
| O6 | C6 | H7 | 110.2° | 109.5° |
| C6 | O6 | H8 | 109.5° | 114.0° |
| C6 | C1 | C2 | 110.5° | 109.5° |
| C6 | C1 | O1 | 107.5° | 109.5° |
| C1 | C6 | H7 | 108.4° | 109.5° |
| C6 | C1 | H9 | 110.9° | 109.5° |
| O2 | C2 | C1 | 111.5° | 109.5° |
| O2 | C2 | H11 | 110.9° | 109.5° |
| C2 | O2 | H12 | 109.5° | 114.0° |
| C2 | C1 | O1 | 106.1° | 109.4° |
| C2 | C1 | H9 | 108.9° | 109.5° |
| C1 | C2 | H11 | 107.3° | 109.4° |
| O1 | C1 | H9 | 112.8° | 109.5° |
| C1 | O1 | H10 | 109.5° | 114.1° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O4 | C4 | C5 | O5 | 61.3° | 60.0° |
| O4 | C4 | C5 | C3 | 118.2° | 120.0° |
| O4 | C4 | C5 | H3 | 120.3° | 120.0° |
| O4 | C4 | C5 | C6 | 176.3° | 180.0° |
| O4 | C4 | C3 | H3 | 123.0° | 120.0° |
| O4 | C4 | C3 | O3 | 67.2° | 60.0° |
| O4 | C4 | C3 | C2 | 171.8° | 180.0° |
| O4 | C4 | C3 | H2 | 52.2° | 60.0° |
| O4 | C4 | C5 | H5 | 58.8° | 60.0° |
| O5 | C5 | C4 | C6 | 122.4° | 120.0° |
| O5 | C5 | C4 | H5 | 120.1° | 120.0° |
| O5 | C5 | C6 | H5 | 119.5° | 120.0° |
| O5 | C5 | C4 | C3 | 179.5° | 180.0° |
| O5 | C5 | C6 | O6 | 56.7° | 60.0° |
| O5 | C5 | C6 | C1 | 176.4° | 180.0° |
| O5 | C5 | C4 | H3 | 59.0° | 60.0° |
| O5 | C5 | C6 | H7 | 64.1° | 60.0° |
| C4 | C5 | C6 | H5 | 117.5° | 120.0° |
| C5 | C4 | C3 | H3 | 121.5° | 120.0° |
| C5 | C4 | C3 | O3 | 177.3° | 180.0° |
| C5 | C4 | C3 | C2 | 56.3° | 60.0° |
| C4 | C5 | C6 | O6 | 179.7° | 180.0° |
| C4 | C5 | C6 | C1 | 60.6° | 60.0° |
| C5 | C4 | C3 | H2 | 63.3° | 60.0° |
| C5 | C4 | O4 | H4 | 180.0° | 60.0° |
| C4 | C5 | O5 | H6 | 180.0° | 180.0° |
| C4 | C5 | C6 | H7 | 58.9° | 60.0° |
| C6 | C5 | C4 | C3 | 58.1° | 60.0° |
| C5 | C6 | O6 | C1 | 122.4° | 120.0° |
| C5 | C6 | O6 | H7 | 119.7° | 120.0° |
| C5 | C6 | C1 | H7 | 119.5° | 120.0° |
| C5 | C6 | C1 | C2 | 56.3° | 60.0° |
| C5 | C6 | C1 | O1 | 171.6° | 180.0° |
| C6 | C5 | C4 | H3 | 63.3° | 60.0° |
| C6 | C5 | O5 | H6 | 57.5° | 60.0° |
| C5 | C6 | O6 | H8 | 180.0° | 180.0° |
| C5 | C6 | C1 | H9 | 64.6° | 60.0° |
| C4 | C3 | O3 | C2 | 125.4° | 120.0° |
| C4 | C3 | O3 | H2 | 118.3° | 120.0° |
| C4 | C3 | C2 | H2 | 119.6° | 120.0° |
| C4 | C3 | C2 | O2 | 172.9° | 180.0° |
| C4 | C3 | C2 | C1 | 51.0° | 60.0° |
| C4 | C3 | O3 | H1 | 180.0° | 60.0° |
| C3 | C4 | O4 | H4 | 60.9° | 180.0° |
| C3 | C4 | C5 | H5 | 59.4° | 60.0° |
| C4 | C3 | C2 | H11 | 65.7° | 60.0° |
| O3 | C3 | C2 | H2 | 117.3° | 120.0° |
| O3 | C3 | C2 | O2 | 63.9° | 60.0° |
| O3 | C3 | C2 | C1 | 174.2° | 180.0° |
| O3 | C3 | C4 | H3 | 55.8° | 60.0° |
| O3 | C3 | C2 | H11 | 57.5° | 60.0° |
| C3 | C2 | C1 | C6 | 50.6° | 60.0° |
| C3 | C2 | O2 | C1 | 120.2° | 120.0° |
| C3 | C2 | O2 | H11 | 120.2° | 120.0° |
| C3 | C2 | C1 | H11 | 117.8° | 120.0° |
| C3 | C2 | C1 | O1 | 166.8° | 180.0° |
| C2 | C3 | O3 | H1 | 54.6° | 180.0° |
| C2 | C3 | C4 | H3 | 65.1° | 60.0° |
| C3 | C2 | C1 | H9 | 71.5° | 60.0° |
| C3 | C2 | O2 | H12 | 180.0° | 180.0° |
| O6 | C6 | C1 | H7 | 119.0° | 120.0° |
| O6 | C6 | C1 | C2 | 177.8° | 180.0° |
| O6 | C6 | C1 | O1 | 66.9° | 60.0° |
| O6 | C6 | C5 | H5 | 62.8° | 60.0° |
| O6 | C6 | C1 | H9 | 56.9° | 60.0° |
| C6 | C1 | C2 | O2 | 171.2° | 180.0° |
| C6 | C1 | C2 | O1 | 116.2° | 120.0° |
| C6 | C1 | C2 | H9 | 122.1° | 120.0° |
| C6 | C1 | O1 | H9 | 122.6° | 120.0° |
| C1 | C6 | C5 | H5 | 56.9° | 60.0° |
| C1 | C6 | O6 | H8 | 57.6° | 60.0° |
| C6 | C1 | O1 | H10 | 180.0° | 180.0° |
| C6 | C1 | C2 | H11 | 67.2° | 60.0° |
| O2 | C2 | C1 | H11 | 121.6° | 120.0° |
| O2 | C2 | C1 | O1 | 72.6° | 60.0° |
| O2 | C2 | C3 | H2 | 53.4° | 60.0° |
| O2 | C2 | C1 | H9 | 49.1° | 60.0° |
| C2 | C1 | O1 | H9 | 119.2° | 120.0° |
| C1 | C2 | C3 | H2 | 68.5° | 60.0° |
| C2 | C1 | C6 | H7 | 63.2° | 60.0° |
| C2 | C1 | O1 | H10 | 61.7° | 60.0° |
| C1 | C2 | O2 | H12 | 59.8° | 60.0° |
| O1 | C1 | C6 | H7 | 52.2° | 60.0° |
| O1 | C1 | C2 | H11 | 49.0° | 60.0° |
| H1 | O3 | C3 | H2 | 61.6° | 60.0° |
| H2 | C3 | C4 | H3 | 175.2° | 180.0° |
| H2 | C3 | C2 | H11 | 174.7° | 179.9° |
| H3 | C4 | O4 | H4 | 61.0° | 60.0° |
| H3 | C4 | C5 | H5 | 179.1° | 180.0° |
| H5 | C5 | O5 | H6 | 61.0° | 60.0° |
| H5 | C5 | C6 | H7 | 176.4° | NaN° |
| H7 | C6 | O6 | H8 | 60.3° | 60.0° |
| H7 | C6 | C1 | H9 | 175.9° | 180.0° |
| H9 | C1 | O1 | H10 | 57.5° | 60.0° |
| H9 | C1 | C2 | H11 | 170.7° | 180.0° |
| H11 | C2 | O2 | H12 | 59.8° | 60.0° |
