WN8
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O6 | C17 | doub | 1.22Å | 1.22Å | |
| C17 | O7 | sing | 1.34Å | 1.46Å | |
| C17 | C16 | sing | 1.47Å | 1.50Å | |
| O7 | C1 | sing | 1.45Å | 1.43Å | |
| C1 | C | sing | 1.53Å | 1.52Å | |
| C1 | C2 | sing | 1.53Å | 1.53Å | |
| C16 | C15 | doub | 1.40Å | 1.39Å | Aromatic |
| C16 | C11 | sing | 1.41Å | 1.39Å | Aromatic |
| C15 | O5 | sing | 1.36Å | 1.36Å | |
| C15 | C14 | sing | 1.38Å | 1.39Å | Aromatic |
| C14 | C13 | doub | 1.39Å | 1.39Å | Aromatic |
| C13 | O4 | sing | 1.36Å | 1.36Å | |
| C13 | C12 | sing | 1.39Å | 1.39Å | Aromatic |
| C12 | C11 | doub | 1.38Å | 1.39Å | Aromatic |
| C11 | O3 | sing | 1.36Å | 1.37Å | |
| O3 | C10 | sing | 1.43Å | 1.43Å | |
| C10 | C9 | sing | 1.53Å | 1.52Å | |
| C9 | C8 | sing | 1.53Å | 1.52Å | |
| C8 | C7 | sing | 1.53Å | 1.52Å | |
| C7 | O2 | sing | 1.43Å | 1.43Å | |
| C7 | C6 | sing | 1.53Å | 1.52Å | |
| C6 | O1 | sing | 1.43Å | 1.43Å | |
| C6 | C5 | sing | 1.51Å | 1.51Å | |
| C5 | O | doub | 1.21Å | 1.22Å | |
| C5 | C4 | sing | 1.51Å | 1.52Å | |
| C4 | C3 | sing | 1.53Å | 1.54Å | |
| C3 | C2 | sing | 1.53Å | 1.52Å | |
| C4 | H41 | sing | 1.09Å | 1.10Å | |
| C4 | H9 | sing | 1.09Å | 1.10Å | |
| C6 | H1 | sing | 1.09Å | 1.10Å | |
| C7 | H2 | sing | 1.10Å | 1.10Å | |
| C8 | H12 | sing | 1.09Å | 1.10Å | |
| C8 | H13 | sing | 1.09Å | 1.10Å | |
| C9 | H15 | sing | 1.09Å | 1.10Å | |
| C9 | H14 | sing | 1.09Å | 1.10Å | |
| C10 | H17 | sing | 1.09Å | 1.10Å | |
| C10 | H16 | sing | 1.09Å | 1.10Å | |
| C12 | H18 | sing | 1.08Å | 1.08Å | |
| C3 | H31 | sing | 1.09Å | 1.10Å | |
| C3 | H8 | sing | 1.09Å | 1.10Å | |
| C2 | H7 | sing | 1.09Å | 1.10Å | |
| C2 | H6 | sing | 1.09Å | 1.10Å | |
| C1 | H | sing | 1.09Å | 1.10Å | |
| C | H4 | sing | 1.09Å | 1.10Å | |
| C | H5 | sing | 1.09Å | 1.10Å | |
| C | H3 | sing | 1.09Å | 1.10Å | |
| C14 | H20 | sing | 1.08Å | 1.08Å | |
| O1 | H10 | sing | 0.97Å | 0.95Å | |
| O2 | H11 | sing | 0.97Å | 0.95Å | |
| O4 | H19 | sing | 0.97Å | 0.95Å | |
| O5 | H21 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O6 | C17 | O7 | 120.2° | 119.7° |
| O6 | C17 | C16 | 119.4° | 119.5° |
| O7 | C17 | C16 | 120.4° | 120.8° |
| C17 | O7 | C1 | 116.9° | 117.8° |
| C17 | C16 | C15 | 119.5° | 120.8° |
| C17 | C16 | C11 | 121.4° | 119.6° |
| O7 | C1 | C | 110.8° | 109.4° |
| O7 | C1 | C2 | 108.9° | 109.7° |
| O7 | C1 | H | 110.3° | 109.6° |
| C | C1 | C2 | 108.8° | 109.4° |
| C | C1 | H | 109.0° | 109.2° |
| C1 | C | H4 | 109.5° | 109.5° |
| C1 | C | H5 | 109.5° | 109.4° |
| C1 | C | H3 | 109.5° | 109.5° |
| C1 | C2 | C3 | 111.7° | 109.3° |
| C1 | C2 | H7 | 108.9° | 109.5° |
| C1 | C2 | H6 | 108.9° | 109.6° |
| C2 | C1 | H | 109.0° | 109.4° |
| C15 | C16 | C11 | 119.1° | 119.5° |
| C16 | C15 | O5 | 120.3° | 120.7° |
| C16 | C15 | C14 | 120.6° | 119.8° |
| C16 | C11 | C12 | 120.3° | 119.7° |
| C16 | C11 | O3 | 121.1° | 120.1° |
| O5 | C15 | C14 | 119.1° | 119.5° |
| C15 | O5 | H21 | 109.5° | 114.1° |
| C15 | C14 | C13 | 120.1° | 120.3° |
| C15 | C14 | H20 | 119.9° | 119.8° |
| C14 | C13 | O4 | 120.6° | 119.9° |
| C14 | C13 | C12 | 119.3° | 120.2° |
| C13 | C14 | H20 | 119.9° | 119.9° |
| O4 | C13 | C12 | 120.1° | 119.9° |
| C13 | O4 | H19 | 109.5° | 114.1° |
| C13 | C12 | C11 | 120.5° | 120.2° |
| C13 | C12 | H18 | 119.7° | 119.9° |
| C12 | C11 | O3 | 118.6° | 120.2° |
| C11 | C12 | H18 | 119.8° | 119.9° |
| C11 | O3 | C10 | 121.9° | 117.5° |
| O3 | C10 | C9 | 107.4° | 109.7° |
| O3 | C10 | H17 | 110.0° | 109.4° |
| O3 | C10 | H16 | 110.0° | 109.7° |
| C10 | C9 | C8 | 108.3° | 109.5° |
| C10 | C9 | H15 | 109.7° | 108.7° |
| C10 | C9 | H14 | 109.8° | 109.3° |
| C9 | C10 | H17 | 110.0° | 109.2° |
| C9 | C10 | H16 | 110.0° | 109.3° |
| C9 | C8 | C7 | 113.4° | 110.6° |
| C9 | C8 | H12 | 108.5° | 109.4° |
| C9 | C8 | H13 | 108.5° | 109.3° |
| C8 | C9 | H15 | 109.8° | 110.0° |
| C8 | C9 | H14 | 109.8° | 109.7° |
| C8 | C7 | O2 | 109.1° | 110.7° |
| C8 | C7 | C6 | 111.8° | 109.7° |
| C8 | C7 | H2 | 108.4° | 108.8° |
| C7 | C8 | H12 | 108.5° | 109.4° |
| C7 | C8 | H13 | 108.5° | 109.3° |
| O2 | C7 | C6 | 109.3° | 110.2° |
| O2 | C7 | H2 | 109.7° | 108.7° |
| C7 | O2 | H11 | 109.5° | 114.0° |
| C7 | C6 | O1 | 108.2° | 109.3° |
| C7 | C6 | C5 | 111.8° | 110.7° |
| C7 | C6 | H1 | 108.7° | 109.0° |
| C6 | C7 | H2 | 108.4° | 108.8° |
| O1 | C6 | C5 | 109.3° | 109.6° |
| O1 | C6 | H1 | 109.9° | 109.0° |
| C6 | O1 | H10 | 109.5° | 114.0° |
| C6 | C5 | O | 119.0° | 120.9° |
| C6 | C5 | C4 | 121.4° | 119.9° |
| C5 | C6 | H1 | 108.9° | 109.2° |
| O | C5 | C4 | 119.6° | 119.2° |
| C5 | C4 | C3 | 113.8° | 109.5° |
| C5 | C4 | H41 | 108.3° | 109.2° |
| C5 | C4 | H9 | 108.4° | 109.6° |
| C4 | C3 | C2 | 114.8° | 109.7° |
| C3 | C4 | H41 | 108.4° | 109.5° |
| C3 | C4 | H9 | 108.4° | 109.6° |
| C4 | C3 | H31 | 108.1° | 109.5° |
| C4 | C3 | H8 | 108.1° | 109.1° |
| C2 | C3 | H31 | 108.1° | 109.7° |
| C2 | C3 | H8 | 108.1° | 109.3° |
| C3 | C2 | H7 | 108.9° | 109.6° |
| C3 | C2 | H6 | 108.9° | 109.4° |
| H41 | C4 | H9 | 109.5° | 109.4° |
| H12 | C8 | H13 | 109.5° | 108.8° |
| H15 | C9 | H14 | 109.5° | 109.6° |
| H17 | C10 | H16 | 109.5° | 109.5° |
| H31 | C3 | H8 | 109.5° | 109.5° |
| H7 | C2 | H6 | 109.4° | 109.4° |
| H4 | C | H5 | 109.5° | 109.4° |
| H4 | C | H3 | 109.5° | 109.5° |
| H5 | C | H3 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O6 | C17 | O7 | C16 | 178.2° | 179.3° |
| O6 | C17 | O7 | C1 | 12.7° | 1.8° |
| O6 | C17 | C16 | C15 | 5.3° | 169.9° |
| O6 | C17 | C16 | C11 | 175.1° | 10.1° |
| C17 | O7 | C1 | C | 67.0° | 177.9° |
| C17 | O7 | C1 | C2 | 173.3° | 62.1° |
| O7 | C17 | C16 | C15 | 172.9° | 9.4° |
| O7 | C17 | C16 | C11 | 6.7° | 170.6° |
| C17 | O7 | C1 | H | 53.7° | 58.1° |
| C16 | C17 | O7 | C1 | 169.1° | 177.5° |
| C17 | C16 | C15 | C11 | 179.6° | 180.0° |
| C17 | C16 | C15 | O5 | 0.5° | 2.2° |
| C17 | C16 | C15 | C14 | 179.7° | 177.6° |
| C17 | C16 | C11 | C12 | 179.2° | 175.7° |
| C17 | C16 | C11 | O3 | 0.1° | 3.8° |
| O7 | C1 | C | C2 | 119.7° | 120.2° |
| O7 | C1 | C | H | 121.5° | 120.0° |
| O7 | C1 | C2 | H | 120.4° | 120.3° |
| O7 | C1 | C2 | C3 | 64.9° | 132.2° |
| O7 | C1 | C2 | H7 | 174.7° | 12.1° |
| O7 | C1 | C2 | H6 | 55.4° | 107.9° |
| O7 | C1 | C | H4 | 180.0° | 179.8° |
| O7 | C1 | C | H5 | 60.0° | 59.8° |
| O7 | C1 | C | H3 | 60.0° | 60.2° |
| C | C1 | C2 | H | 118.7° | 119.7° |
| C | C1 | C2 | C3 | 174.2° | 107.8° |
| C | C1 | C2 | H7 | 53.9° | 132.2° |
| C | C1 | C2 | H6 | 65.4° | 12.1° |
| C1 | C | H4 | H5 | 120.0° | 119.9° |
| C1 | C | H4 | H3 | 120.0° | 120.0° |
| C1 | C | H5 | H3 | 120.0° | 120.0° |
| C1 | C2 | C3 | C4 | 169.0° | 178.4° |
| C1 | C2 | C3 | H7 | 120.4° | 120.0° |
| C1 | C2 | C3 | H6 | 120.4° | 120.0° |
| C1 | C2 | C3 | H31 | 70.2° | 61.2° |
| C1 | C2 | C3 | H8 | 48.2° | 58.8° |
| C1 | C2 | H7 | H6 | 119.0° | 120.2° |
| C2 | C1 | C | H4 | 60.3° | 60.0° |
| C2 | C1 | C | H5 | 179.7° | 180.0° |
| C2 | C1 | C | H3 | 59.7° | 60.0° |
| C16 | C15 | O5 | C14 | 179.8° | 179.8° |
| C16 | C15 | C14 | C13 | 0.2° | 0.5° |
| C15 | C16 | C11 | C12 | 0.4° | 4.3° |
| C15 | C16 | C11 | O3 | 179.5° | 176.2° |
| C16 | C15 | C14 | H20 | 179.8° | 179.8° |
| C16 | C15 | O5 | H21 | 1.8° | 90.2° |
| C11 | C16 | C15 | O5 | 179.9° | 177.8° |
| C11 | C16 | C15 | C14 | 0.1° | 2.4° |
| C16 | C11 | C12 | C13 | 0.8° | 3.4° |
| C16 | C11 | C12 | O3 | 179.1° | 179.5° |
| C16 | C11 | O3 | C10 | 159.0° | 120.7° |
| C16 | C11 | C12 | H18 | 179.2° | 177.2° |
| O5 | C15 | C14 | C13 | 179.9° | 179.3° |
| O5 | C15 | C14 | H20 | 0.0° | 0.4° |
| C15 | C14 | C13 | H20 | 180.0° | 179.7° |
| C15 | C14 | C13 | O4 | 180.0° | 178.6° |
| C15 | C14 | C13 | C12 | 0.1° | 1.5° |
| C14 | C15 | O5 | H21 | 178.0° | 90.0° |
| C14 | C13 | O4 | C12 | 179.8° | 180.0° |
| C14 | C13 | C12 | C11 | 0.6° | 0.5° |
| C14 | C13 | C12 | H18 | 179.3° | 179.9° |
| C14 | C13 | O4 | H19 | 180.0° | 90.0° |
| O4 | C13 | C12 | C11 | 179.5° | 179.4° |
| O4 | C13 | C12 | H18 | 0.5° | 0.1° |
| O4 | C13 | C14 | H20 | 0.0° | 1.1° |
| C13 | C12 | C11 | H18 | 180.0° | 179.4° |
| C13 | C12 | C11 | O3 | 179.9° | 177.1° |
| C12 | C13 | C14 | H20 | 179.8° | 178.8° |
| C12 | C13 | O4 | H19 | 0.2° | 90.0° |
| C12 | C11 | O3 | C10 | 21.9° | 59.8° |
| C11 | O3 | C10 | C9 | 151.1° | 120.6° |
| C11 | O3 | C10 | H17 | 89.2° | 119.6° |
| C11 | O3 | C10 | H16 | 31.5° | 0.5° |
| O3 | C11 | C12 | H18 | 0.1° | 2.3° |
| O3 | C10 | C9 | H17 | 119.7° | 119.9° |
| O3 | C10 | C9 | H16 | 119.6° | 120.3° |
| O3 | C10 | C9 | C8 | 5.5° | 60.5° |
| O3 | C10 | C9 | H15 | 125.4° | 179.3° |
| O3 | C10 | C9 | H14 | 114.3° | 59.7° |
| O3 | C10 | H17 | H16 | 121.0° | 120.2° |
| C10 | C9 | C8 | H15 | 119.8° | 119.4° |
| C10 | C9 | C8 | H14 | 119.8° | 120.0° |
| C10 | C9 | C8 | C7 | 150.0° | 163.9° |
| C10 | C9 | C8 | H12 | 29.4° | 75.6° |
| C10 | C9 | C8 | H13 | 89.4° | 43.4° |
| C10 | C9 | H15 | H14 | 120.5° | 119.4° |
| C9 | C10 | H17 | H16 | 121.0° | 119.7° |
| C9 | C8 | C7 | H12 | 120.6° | 120.5° |
| C9 | C8 | C7 | H13 | 120.6° | 120.4° |
| C9 | C8 | C7 | O2 | 18.9° | 2.2° |
| C9 | C8 | C7 | C6 | 102.2° | 119.6° |
| C9 | C8 | C7 | H2 | 138.3° | 121.6° |
| C9 | C8 | H12 | H13 | 118.2° | 119.3° |
| C8 | C9 | H15 | H14 | 120.5° | 120.7° |
| C8 | C9 | C10 | H17 | 114.1° | 59.3° |
| C8 | C9 | C10 | H16 | 125.2° | 179.1° |
| C8 | C7 | O2 | C6 | 122.6° | 121.5° |
| C8 | C7 | O2 | H2 | 118.6° | 119.4° |
| C8 | C7 | C6 | H2 | 119.5° | 118.8° |
| C8 | C7 | C6 | O1 | 80.0° | 167.4° |
| C8 | C7 | C6 | C5 | 40.4° | 71.8° |
| C8 | C7 | C6 | H1 | 160.6° | 48.4° |
| C7 | C8 | H12 | H13 | 118.2° | 119.4° |
| C7 | C8 | C9 | H15 | 90.2° | 44.4° |
| C7 | C8 | C9 | H14 | 30.2° | 76.2° |
| C8 | C7 | O2 | H11 | 180.0° | 178.5° |
| O2 | C7 | C6 | H2 | 119.6° | 119.1° |
| O2 | C7 | C6 | O1 | 40.9° | 70.5° |
| O2 | C7 | C6 | C5 | 161.3° | 50.3° |
| O2 | C7 | C6 | H1 | 78.5° | 170.4° |
| O2 | C7 | C8 | H12 | 101.7° | 122.7° |
| O2 | C7 | C8 | H13 | 139.4° | 118.2° |
| C7 | C6 | O1 | C5 | 121.9° | 121.5° |
| C7 | C6 | O1 | H1 | 118.6° | 119.1° |
| C7 | C6 | C5 | H1 | 120.1° | 120.0° |
| C7 | C6 | C5 | O | 106.3° | 10.3° |
| C7 | C6 | C5 | C4 | 74.9° | 169.7° |
| C6 | C7 | C8 | H12 | 137.2° | 1.0° |
| C6 | C7 | C8 | H13 | 18.4° | 120.0° |
| C7 | C6 | O1 | H10 | 115.8° | 178.5° |
| C6 | C7 | O2 | H11 | 57.4° | 60.1° |
| O1 | C6 | C5 | H1 | 120.1° | 119.3° |
| O1 | C6 | C5 | O | 13.5° | 110.4° |
| O1 | C6 | C5 | C4 | 165.4° | 69.6° |
| O1 | C6 | C7 | H2 | 160.5° | 48.6° |
| C6 | C5 | O | C4 | 178.9° | 180.0° |
| C6 | C5 | C4 | C3 | 100.4° | 101.7° |
| C6 | C5 | C4 | H41 | 138.9° | 138.4° |
| C6 | C5 | C4 | H9 | 20.2° | 18.6° |
| C5 | C6 | C7 | H2 | 79.2° | 169.4° |
| C5 | C6 | O1 | H10 | 6.1° | 60.0° |
| O | C5 | C4 | C3 | 80.7° | 78.3° |
| O | C5 | C4 | H41 | 39.9° | 41.5° |
| O | C5 | C4 | H9 | 158.6° | 161.4° |
| O | C5 | C6 | H1 | 133.6° | 130.3° |
| C5 | C4 | C3 | H41 | 120.6° | 119.7° |
| C5 | C4 | C3 | H9 | 120.6° | 120.2° |
| C5 | C4 | C3 | C2 | 61.1° | 68.2° |
| C5 | C4 | H41 | H9 | 118.0° | 119.9° |
| C4 | C5 | C6 | H1 | 45.3° | 49.7° |
| C5 | C4 | C3 | H31 | 178.1° | 171.3° |
| C5 | C4 | C3 | H8 | 59.7° | 51.5° |
| C4 | C3 | C2 | H31 | 120.8° | 120.4° |
| C4 | C3 | C2 | H8 | 120.8° | 119.6° |
| C3 | C4 | H41 | H9 | 118.0° | 120.2° |
| C4 | C3 | H31 | H8 | 117.5° | 119.6° |
| C4 | C3 | C2 | H7 | 70.7° | 58.4° |
| C4 | C3 | C2 | H6 | 48.6° | 61.5° |
| C2 | C3 | C4 | H41 | 59.6° | 51.5° |
| C2 | C3 | C4 | H9 | 178.3° | 171.6° |
| C2 | C3 | H31 | H8 | 117.6° | 119.9° |
| C3 | C2 | H7 | H6 | 119.0° | 119.9° |
| C3 | C2 | C1 | H | 55.5° | 11.9° |
| H41 | C4 | C3 | H31 | 61.3° | 68.9° |
| H41 | C4 | C3 | H8 | 179.7° | 171.2° |
| H9 | C4 | C3 | H31 | 57.5° | 51.1° |
| H9 | C4 | C3 | H8 | 60.9° | 68.7° |
| H1 | C6 | C7 | H2 | 41.1° | 70.5° |
| H1 | C6 | O1 | H10 | 125.6° | 59.4° |
| H2 | C7 | C8 | H12 | 17.7° | 117.9° |
| H2 | C7 | C8 | H13 | 101.1° | 1.2° |
| H2 | C7 | O2 | H11 | 61.4° | 59.0° |
| H12 | C8 | C9 | H15 | 149.2° | 165.0° |
| H12 | C8 | C9 | H14 | 90.4° | 44.4° |
| H13 | C8 | C9 | H15 | 30.4° | 76.0° |
| H13 | C8 | C9 | H14 | 150.8° | 163.4° |
| H15 | C9 | C10 | H17 | 5.7° | 60.8° |
| H15 | C9 | C10 | H16 | 115.0° | 58.9° |
| H14 | C9 | C10 | H17 | 126.0° | 179.6° |
| H14 | C9 | C10 | H16 | 5.4° | 60.7° |
| H31 | C3 | C2 | H7 | 50.1° | 178.8° |
| H31 | C3 | C2 | H6 | 169.4° | 58.8° |
| H8 | C3 | C2 | H7 | 168.6° | 61.2° |
| H8 | C3 | C2 | H6 | 72.2° | 178.8° |
| H7 | C2 | C1 | H | 64.9° | 108.2° |
| H6 | C2 | C1 | H | 175.8° | 131.8° |
| H | C1 | C | H4 | 58.5° | 59.7° |
| H | C1 | C | H5 | 61.5° | 60.2° |
| H | C1 | C | H3 | 178.5° | 179.8° |
| H4 | C | H5 | H3 | 120.0° | 120.0° |
