C7H
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C7 | C6 | doub | 1.38Å | 1.39Å | Aromatic |
| C7 | C8 | sing | 1.39Å | 1.39Å | Aromatic |
| C6 | C14 | sing | 1.39Å | 1.40Å | Aromatic |
| C3 | C4 | doub | 1.38Å | 1.39Å | Aromatic |
| C3 | C2 | sing | 1.39Å | 1.39Å | Aromatic |
| C4 | C13 | sing | 1.39Å | 1.40Å | Aromatic |
| C8 | C9 | doub | 1.39Å | 1.39Å | Aromatic |
| C14 | C5 | sing | 1.48Å | 1.51Å | |
| C14 | C15 | doub | 1.41Å | 1.39Å | Aromatic |
| C2 | C1 | doub | 1.38Å | 1.39Å | Aromatic |
| C13 | C5 | sing | 1.48Å | 1.50Å | |
| C13 | C12 | doub | 1.41Å | 1.39Å | Aromatic |
| C5 | C16 | doub | 1.34Å | 1.36Å | |
| C16 | C20 | sing | 1.51Å | 1.52Å | |
| C16 | C17 | sing | 1.51Å | 1.51Å | |
| C20 | C19 | sing | 1.53Å | 1.53Å | |
| C17 | C18 | sing | 1.53Å | 1.52Å | |
| C9 | C15 | sing | 1.40Å | 1.39Å | Aromatic |
| N | C19 | sing | 1.47Å | 1.47Å | |
| N | C18 | sing | 1.47Å | 1.46Å | |
| N | C21 | sing | 1.47Å | 1.47Å | |
| C15 | C10 | sing | 1.46Å | 1.49Å | |
| C1 | C12 | sing | 1.40Å | 1.39Å | Aromatic |
| C12 | C11 | sing | 1.46Å | 1.49Å | |
| C10 | C11 | doub | 1.32Å | 1.34Å | |
| C17 | H2 | sing | 1.09Å | 1.10Å | |
| C17 | H3 | sing | 1.09Å | 1.10Å | |
| C18 | H4 | sing | 1.09Å | 1.10Å | |
| C18 | H5 | sing | 1.09Å | 1.10Å | |
| C21 | H6 | sing | 1.09Å | 1.10Å | |
| C21 | H7 | sing | 1.09Å | 1.10Å | |
| C21 | H8 | sing | 1.09Å | 1.10Å | |
| C19 | H9 | sing | 1.09Å | 1.10Å | |
| C19 | H10 | sing | 1.09Å | 1.10Å | |
| C20 | H11 | sing | 1.09Å | 1.10Å | |
| C20 | H12 | sing | 1.09Å | 1.10Å | |
| C4 | H13 | sing | 1.08Å | 1.08Å | |
| C3 | H14 | sing | 1.08Å | 1.08Å | |
| C2 | H15 | sing | 1.08Å | 1.08Å | |
| C1 | H16 | sing | 1.08Å | 1.08Å | |
| C11 | H17 | sing | 1.08Å | 1.08Å | |
| C10 | H18 | sing | 1.08Å | 1.08Å | |
| C6 | H19 | sing | 1.08Å | 1.08Å | |
| C7 | H20 | sing | 1.08Å | 1.08Å | |
| C8 | H21 | sing | 1.08Å | 1.08Å | |
| C9 | H22 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C6 | C7 | C8 | 119.3° | 120.3° |
| C7 | C6 | C14 | 120.8° | 120.0° |
| C7 | C6 | H19 | 119.6° | 120.0° |
| C6 | C7 | H20 | 120.3° | 119.9° |
| C7 | C8 | C9 | 120.2° | 120.6° |
| C8 | C7 | H20 | 120.4° | 119.8° |
| C7 | C8 | H21 | 119.9° | 119.7° |
| C6 | C14 | C5 | 120.5° | 120.0° |
| C6 | C14 | C15 | 119.5° | 120.2° |
| C14 | C6 | H19 | 119.6° | 119.9° |
| C4 | C3 | C2 | 119.2° | 120.2° |
| C3 | C4 | C13 | 121.3° | 120.0° |
| C3 | C4 | H13 | 119.4° | 120.0° |
| C4 | C3 | H14 | 120.4° | 119.9° |
| C3 | C2 | C1 | 119.9° | 120.6° |
| C2 | C3 | H14 | 120.4° | 119.9° |
| C3 | C2 | H15 | 120.0° | 119.7° |
| C4 | C13 | C5 | 120.8° | 120.1° |
| C4 | C13 | C12 | 119.2° | 120.0° |
| C13 | C4 | H13 | 119.3° | 120.0° |
| C8 | C9 | C15 | 120.5° | 119.8° |
| C9 | C8 | H21 | 119.9° | 119.6° |
| C8 | C9 | H22 | 119.7° | 119.9° |
| C5 | C14 | C15 | 120.0° | 119.9° |
| C14 | C5 | C13 | 115.8° | 118.2° |
| C14 | C5 | C16 | 122.4° | 120.9° |
| C14 | C15 | C9 | 119.7° | 119.0° |
| C14 | C15 | C10 | 122.7° | 121.3° |
| C2 | C1 | C12 | 120.8° | 120.1° |
| C1 | C2 | H15 | 120.1° | 119.7° |
| C2 | C1 | H16 | 119.6° | 119.9° |
| C5 | C13 | C12 | 120.0° | 119.9° |
| C13 | C5 | C16 | 121.7° | 120.9° |
| C13 | C12 | C1 | 119.6° | 119.0° |
| C13 | C12 | C11 | 122.9° | 121.3° |
| C5 | C16 | C20 | 122.5° | 121.1° |
| C5 | C16 | C17 | 121.5° | 121.1° |
| C20 | C16 | C17 | 116.0° | 117.8° |
| C16 | C20 | C19 | 113.0° | 108.2° |
| C16 | C20 | H11 | 108.6° | 109.7° |
| C16 | C20 | H12 | 108.6° | 109.7° |
| C16 | C17 | C18 | 110.8° | 108.2° |
| C16 | C17 | H2 | 109.2° | 109.7° |
| C16 | C17 | H3 | 109.1° | 109.8° |
| C20 | C19 | N | 108.9° | 109.4° |
| C20 | C19 | H9 | 109.6° | 109.5° |
| C20 | C19 | H10 | 109.6° | 109.5° |
| C19 | C20 | H11 | 108.6° | 109.7° |
| C19 | C20 | H12 | 108.6° | 109.7° |
| C17 | C18 | N | 108.9° | 109.4° |
| C18 | C17 | H2 | 109.1° | 109.7° |
| C18 | C17 | H3 | 109.1° | 109.7° |
| C17 | C18 | H4 | 109.6° | 109.5° |
| C17 | C18 | H5 | 109.6° | 109.5° |
| C9 | C15 | C10 | 117.5° | 119.7° |
| C15 | C9 | H22 | 119.7° | 120.3° |
| C19 | N | C18 | 107.1° | 111.6° |
| C19 | N | C21 | 110.3° | 111.0° |
| N | C19 | H9 | 109.6° | 109.5° |
| N | C19 | H10 | 109.6° | 109.5° |
| C18 | N | C21 | 109.6° | 111.0° |
| N | C18 | H4 | 109.6° | 109.5° |
| N | C18 | H5 | 109.6° | 109.5° |
| N | C21 | H6 | 109.5° | 109.5° |
| N | C21 | H7 | 109.4° | 109.5° |
| N | C21 | H8 | 109.5° | 109.4° |
| C15 | C10 | C11 | 127.4° | 127.5° |
| C15 | C10 | H18 | 116.3° | 116.2° |
| C1 | C12 | C11 | 117.5° | 119.6° |
| C12 | C1 | H16 | 119.6° | 120.0° |
| C12 | C11 | C10 | 126.5° | 127.6° |
| C12 | C11 | H17 | 116.7° | 116.2° |
| C10 | C11 | H17 | 116.7° | 116.1° |
| C11 | C10 | H18 | 116.3° | 116.3° |
| H2 | C17 | H3 | 109.5° | 109.7° |
| H4 | C18 | H5 | 109.5° | 109.5° |
| H6 | C21 | H7 | 109.5° | 109.5° |
| H6 | C21 | H8 | 109.4° | 109.5° |
| H7 | C21 | H8 | 109.5° | 109.5° |
| H9 | C19 | H10 | 109.5° | 109.5° |
| H11 | C20 | H12 | 109.4° | 109.7° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C6 | C7 | C8 | H20 | 180.0° | 179.9° |
| C7 | C6 | C14 | H19 | 180.0° | 180.0° |
| C6 | C7 | C8 | C9 | 0.4° | 1.6° |
| C7 | C6 | C14 | C5 | 179.8° | 177.1° |
| C7 | C6 | C14 | C15 | 1.8° | 2.2° |
| C6 | C7 | C8 | H21 | 179.7° | 178.6° |
| C8 | C7 | C6 | C14 | 1.0° | 0.2° |
| C7 | C8 | C9 | H21 | 180.0° | 179.8° |
| C7 | C8 | C9 | C15 | 0.5° | 0.5° |
| C8 | C7 | C6 | H19 | 179.0° | 179.8° |
| C7 | C8 | C9 | H22 | 179.5° | 179.8° |
| C6 | C14 | C5 | C15 | 178.3° | 179.4° |
| C6 | C14 | C5 | C13 | 117.0° | 120.2° |
| C6 | C14 | C5 | C16 | 62.9° | 59.5° |
| C6 | C14 | C15 | C9 | 2.0° | 3.3° |
| C6 | C14 | C15 | C10 | 180.0° | 176.0° |
| C14 | C6 | C7 | H20 | 179.0° | 179.8° |
| C4 | C3 | C2 | H14 | 180.0° | 180.0° |
| C3 | C4 | C13 | H13 | 180.0° | 180.0° |
| C4 | C3 | C2 | C1 | 0.0° | 1.1° |
| C3 | C4 | C13 | C5 | 179.7° | 177.6° |
| C3 | C4 | C13 | C12 | 2.0° | 1.8° |
| C4 | C3 | C2 | H15 | 180.0° | 178.8° |
| C2 | C3 | C4 | C13 | 1.0° | 0.2° |
| C3 | C2 | C1 | H15 | 180.0° | 179.9° |
| C3 | C2 | C1 | C12 | 0.0° | 0.2° |
| C2 | C3 | C4 | H13 | 179.0° | 179.8° |
| C3 | C2 | C1 | H16 | 180.0° | 179.8° |
| C4 | C13 | C5 | C14 | 116.2° | 121.0° |
| C4 | C13 | C5 | C12 | 178.3° | 179.5° |
| C4 | C13 | C5 | C16 | 63.8° | 58.6° |
| C4 | C13 | C12 | C1 | 1.9° | 3.1° |
| C4 | C13 | C12 | C11 | 179.3° | 174.8° |
| C13 | C4 | C3 | H14 | 179.0° | 179.7° |
| C8 | C9 | C15 | C14 | 1.3° | 2.0° |
| C8 | C9 | C15 | H22 | 180.0° | 179.7° |
| C8 | C9 | C15 | C10 | 179.5° | 177.4° |
| C9 | C8 | C7 | H20 | 179.7° | 178.5° |
| C14 | C5 | C13 | C16 | 179.9° | 179.7° |
| C14 | C5 | C13 | C12 | 62.2° | 58.4° |
| C14 | C5 | C16 | C20 | 0.4° | 0.3° |
| C14 | C5 | C16 | C17 | 179.5° | 179.7° |
| C5 | C14 | C15 | C9 | 179.7° | 176.0° |
| C5 | C14 | C15 | C10 | 1.6° | 4.6° |
| C5 | C14 | C6 | H19 | 0.1° | 2.9° |
| C15 | C14 | C5 | C13 | 61.3° | 59.1° |
| C15 | C14 | C5 | C16 | 118.7° | 121.2° |
| C14 | C15 | C9 | C10 | 178.2° | 179.4° |
| C14 | C15 | C10 | C11 | 37.0° | 40.4° |
| C14 | C15 | C10 | H18 | 143.0° | 139.6° |
| C15 | C14 | C6 | H19 | 178.2° | 177.7° |
| C14 | C15 | C9 | H22 | 178.7° | 177.7° |
| C2 | C1 | C12 | C13 | 1.0° | 2.2° |
| C2 | C1 | C12 | H16 | 180.0° | 180.0° |
| C2 | C1 | C12 | C11 | 179.8° | 175.6° |
| C1 | C2 | C3 | H14 | 180.0° | 178.9° |
| C13 | C5 | C16 | C20 | 179.5° | 180.0° |
| C13 | C5 | C16 | C17 | 0.4° | 0.0° |
| C5 | C13 | C12 | C1 | 179.7° | 176.4° |
| C5 | C13 | C12 | C11 | 0.9° | 5.7° |
| C5 | C13 | C4 | H13 | 0.4° | 2.4° |
| C12 | C13 | C5 | C16 | 117.9° | 121.9° |
| C13 | C12 | C1 | C11 | 178.8° | 177.9° |
| C13 | C12 | C11 | C10 | 38.1° | 40.9° |
| C12 | C13 | C4 | H13 | 178.0° | 178.1° |
| C13 | C12 | C1 | H16 | 179.0° | 177.8° |
| C13 | C12 | C11 | H17 | 141.9° | 139.2° |
| C5 | C16 | C20 | C17 | 179.2° | 179.9° |
| C5 | C16 | C20 | C19 | 144.1° | 131.0° |
| C5 | C16 | C17 | C18 | 141.5° | 131.0° |
| C5 | C16 | C17 | H2 | 21.3° | 109.3° |
| C5 | C16 | C17 | H3 | 98.3° | 11.3° |
| C5 | C16 | C20 | H11 | 95.4° | 11.3° |
| C5 | C16 | C20 | H12 | 23.5° | 109.3° |
| C16 | C20 | C19 | H11 | 120.5° | 119.7° |
| C16 | C20 | C19 | H12 | 120.5° | 119.7° |
| C20 | C16 | C17 | C18 | 39.3° | 49.1° |
| C16 | C20 | C19 | N | 50.0° | 53.8° |
| C20 | C16 | C17 | H2 | 159.5° | 70.6° |
| C20 | C16 | C17 | H3 | 80.9° | 168.8° |
| C16 | C20 | C19 | H9 | 170.0° | 66.2° |
| C16 | C20 | C19 | H10 | 69.9° | 173.8° |
| C16 | C20 | H11 | H12 | 118.4° | 120.7° |
| C17 | C16 | C20 | C19 | 36.8° | 49.0° |
| C16 | C17 | C18 | H2 | 120.2° | 119.7° |
| C16 | C17 | C18 | H3 | 120.2° | 119.7° |
| C16 | C17 | C18 | N | 56.3° | 53.8° |
| C16 | C17 | H2 | H3 | 119.4° | 120.6° |
| C16 | C17 | C18 | H4 | 63.6° | 173.8° |
| C16 | C17 | C18 | H5 | 176.2° | 66.2° |
| C17 | C16 | C20 | H11 | 83.8° | 168.7° |
| C17 | C16 | C20 | H12 | 157.3° | 70.6° |
| C20 | C19 | N | H9 | 119.9° | 119.9° |
| C20 | C19 | N | H10 | 119.9° | 120.0° |
| C20 | C19 | N | C18 | 68.2° | 65.4° |
| C20 | C19 | N | C21 | 172.6° | 170.3° |
| C20 | C19 | H9 | H10 | 120.2° | 120.1° |
| C19 | C20 | H11 | H12 | 118.4° | 120.5° |
| C17 | C18 | N | C19 | 72.2° | 65.4° |
| C17 | C18 | N | H4 | 119.9° | 120.0° |
| C17 | C18 | N | H5 | 119.9° | 120.0° |
| C17 | C18 | N | C21 | 168.1° | 170.3° |
| C18 | C17 | H2 | H3 | 119.4° | 120.6° |
| C17 | C18 | H4 | H5 | 120.3° | 120.1° |
| C9 | C15 | C10 | C11 | 144.8° | 140.2° |
| C9 | C15 | C10 | H18 | 35.1° | 39.8° |
| C15 | C9 | C8 | H21 | 179.5° | 179.7° |
| C19 | N | C18 | C21 | 119.7° | 124.3° |
| C19 | N | C18 | H4 | 47.7° | 174.6° |
| C19 | N | C18 | H5 | 167.9° | 54.6° |
| C19 | N | C21 | H6 | 180.0° | 60.0° |
| C19 | N | C21 | H7 | 60.0° | 180.0° |
| C19 | N | C21 | H8 | 60.0° | 60.0° |
| N | C19 | H9 | H10 | 120.3° | 120.0° |
| N | C19 | C20 | H11 | 70.5° | 173.5° |
| N | C19 | C20 | H12 | 170.6° | 65.9° |
| N | C18 | C17 | H2 | 176.5° | 65.9° |
| N | C18 | C17 | H3 | 63.9° | 173.5° |
| N | C18 | H4 | H5 | 120.3° | 120.0° |
| C18 | N | C21 | H6 | 62.2° | 64.7° |
| C18 | N | C21 | H7 | 177.8° | 55.3° |
| C18 | N | C21 | H8 | 57.8° | 175.3° |
| C18 | N | C19 | H9 | 171.9° | 54.6° |
| C18 | N | C19 | H10 | 51.7° | 174.6° |
| C21 | N | C18 | H4 | 72.0° | 50.3° |
| C21 | N | C18 | H5 | 48.2° | 69.8° |
| N | C21 | H6 | H7 | 120.0° | 120.0° |
| N | C21 | H6 | H8 | 120.0° | 120.0° |
| N | C21 | H7 | H8 | 120.0° | 119.9° |
| C21 | N | C19 | H9 | 52.6° | 69.7° |
| C21 | N | C19 | H10 | 67.6° | 50.3° |
| C15 | C10 | C11 | C12 | 1.1° | 0.1° |
| C15 | C10 | C11 | H18 | 180.0° | 180.0° |
| C15 | C10 | C11 | H17 | 178.9° | 179.8° |
| C10 | C15 | C9 | H22 | 0.5° | 2.9° |
| C1 | C12 | C11 | C10 | 143.1° | 141.3° |
| C12 | C1 | C2 | H15 | 180.0° | 179.9° |
| C1 | C12 | C11 | H17 | 36.9° | 38.6° |
| C12 | C11 | C10 | H17 | 180.0° | 179.9° |
| C11 | C12 | C1 | H16 | 0.2° | 4.4° |
| C12 | C11 | C10 | H18 | 178.9° | 179.8° |
| H2 | C17 | C18 | H4 | 56.6° | 54.1° |
| H2 | C17 | C18 | H5 | 63.6° | 174.1° |
| H3 | C17 | C18 | H4 | 176.2° | 66.5° |
| H3 | C17 | C18 | H5 | 56.0° | 53.6° |
| H6 | C21 | H7 | H8 | 120.0° | 120.0° |
| H9 | C19 | C20 | H11 | 49.4° | 53.6° |
| H9 | C19 | C20 | H12 | 69.5° | 174.1° |
| H10 | C19 | C20 | H11 | 169.6° | 66.5° |
| H10 | C19 | C20 | H12 | 50.6° | 54.1° |
| H13 | C4 | C3 | H14 | 1.0° | 0.3° |
| H14 | C3 | C2 | H15 | 0.0° | 1.2° |
| H15 | C2 | C1 | H16 | 0.0° | 0.1° |
| H17 | C11 | C10 | H18 | 1.1° | 0.2° |
| H19 | C6 | C7 | H20 | 1.0° | 0.1° |
| H20 | C7 | C8 | H21 | 0.3° | 1.4° |
| H21 | C8 | C9 | H22 | 0.5° | 0.0° |
