H11
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C4 | N17 | sing | 1.36Å | 1.34Å | |
| C4 | S | sing | 1.72Å | 1.76Å | |
| C4 | N | doub | 1.31Å | 1.32Å | |
| C5 | C | sing | 1.53Å | 1.52Å | |
| C5 | C3 | sing | 1.53Å | 1.53Å | |
| C6 | C | sing | 1.53Å | 1.53Å | |
| C7 | C8 | sing | 1.53Å | 1.51Å | |
| C7 | C9 | sing | 1.53Å | 1.53Å | |
| C7 | N17 | sing | 1.46Å | 1.47Å | |
| C8 | C10 | sing | 1.53Å | 1.52Å | |
| C10 | C11 | sing | 1.53Å | 1.55Å | |
| C13 | C12 | sing | 1.53Å | 1.53Å | |
| C13 | C14 | sing | 1.53Å | 1.54Å | |
| C15 | C3 | sing | 1.53Å | 1.54Å | |
| C11 | C12 | sing | 1.53Å | 1.55Å | |
| C14 | C9 | sing | 1.53Å | 1.56Å | |
| S | C | sing | 1.83Å | 1.80Å | |
| N | C2 | sing | 1.31Å | 1.33Å | |
| C2 | O | doub | 1.21Å | 1.22Å | |
| C2 | C | sing | 1.52Å | 1.56Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| C5 | H5A | sing | 1.09Å | 1.10Å | |
| C6 | H6 | sing | 1.09Å | 1.10Å | |
| C6 | H6A | sing | 1.09Å | 1.10Å | |
| C6 | H6B | sing | 1.09Å | 1.10Å | |
| C7 | H7 | sing | 1.09Å | 1.10Å | |
| C8 | H8 | sing | 1.09Å | 1.10Å | |
| C8 | H8A | sing | 1.09Å | 1.10Å | |
| C10 | H10 | sing | 1.09Å | 1.10Å | |
| C10 | H10A | sing | 1.09Å | 1.10Å | |
| C13 | H13 | sing | 1.09Å | 1.10Å | |
| C13 | H13A | sing | 1.09Å | 1.10Å | |
| C15 | H15 | sing | 1.09Å | 1.10Å | |
| C15 | H15A | sing | 1.09Å | 1.10Å | |
| C15 | H15B | sing | 1.09Å | 1.10Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C11 | H11A | sing | 1.09Å | 1.10Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H12A | sing | 1.09Å | 1.10Å | |
| C14 | H14 | sing | 1.09Å | 1.10Å | |
| C14 | H14A | sing | 1.09Å | 1.10Å | |
| C9 | H9 | sing | 1.09Å | 1.10Å | |
| C9 | H9A | sing | 1.09Å | 1.10Å | |
| N17 | HN17 | sing | 0.97Å | 1.00Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| C3 | H3A | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N17 | C4 | S | 125.2° | 125.7° |
| N17 | C4 | N | 121.4° | 125.7° |
| C4 | N17 | C7 | 119.3° | 120.0° |
| C4 | N17 | HN17 | 120.4° | 120.0° |
| S | C4 | N | 113.4° | 108.6° |
| C4 | S | C | 94.3° | 94.3° |
| C4 | N | C2 | 113.7° | 122.1° |
| C | C5 | C3 | 108.8° | 109.4° |
| C5 | C | C6 | 112.3° | 110.8° |
| C5 | C | S | 111.2° | 110.8° |
| C5 | C | C2 | 113.0° | 110.7° |
| C | C5 | H5 | 109.7° | 109.4° |
| C | C5 | H5A | 109.8° | 109.5° |
| C5 | C3 | C15 | 114.5° | 109.4° |
| C3 | C5 | H5 | 109.7° | 109.5° |
| C3 | C5 | H5A | 109.8° | 109.5° |
| C5 | C3 | H3 | 107.8° | 109.5° |
| C5 | C3 | H3A | 106.7° | 109.5° |
| C6 | C | S | 107.3° | 110.8° |
| C6 | C | C2 | 112.0° | 111.2° |
| C | C6 | H6 | 109.5° | 109.4° |
| C | C6 | H6A | 109.5° | 109.5° |
| C | C6 | H6B | 109.5° | 109.5° |
| C8 | C7 | C9 | 111.9° | 109.5° |
| C8 | C7 | N17 | 101.6° | 109.5° |
| C7 | C8 | C10 | 110.4° | 109.5° |
| C8 | C7 | H7 | 114.3° | 109.5° |
| C7 | C8 | H8 | 109.2° | 109.5° |
| C7 | C8 | H8A | 109.0° | 109.4° |
| C9 | C7 | N17 | 112.9° | 109.5° |
| C7 | C9 | C14 | 115.2° | 109.5° |
| C9 | C7 | H7 | 103.2° | 109.4° |
| C7 | C9 | H9 | 107.6° | 109.5° |
| C7 | C9 | H9A | 106.3° | 109.5° |
| N17 | C7 | H7 | 113.3° | 109.5° |
| C7 | N17 | HN17 | 120.4° | 119.9° |
| C8 | C10 | C11 | 107.2° | 109.4° |
| C10 | C8 | H8 | 109.2° | 109.5° |
| C10 | C8 | H8A | 108.9° | 109.4° |
| C8 | C10 | H10 | 110.2° | 109.5° |
| C8 | C10 | H10A | 110.7° | 109.4° |
| C10 | C11 | C12 | 111.5° | 109.5° |
| C11 | C10 | H10 | 110.2° | 109.4° |
| C11 | C10 | H10A | 110.7° | 109.5° |
| C10 | C11 | H11 | 108.8° | 109.5° |
| C10 | C11 | H11A | 108.4° | 109.5° |
| C12 | C13 | C14 | 107.6° | 109.5° |
| C13 | C12 | C11 | 114.2° | 109.5° |
| C12 | C13 | H13 | 110.1° | 109.5° |
| C12 | C13 | H13A | 110.6° | 109.4° |
| C13 | C12 | H12 | 107.9° | 109.5° |
| C13 | C12 | H12A | 106.8° | 109.5° |
| C13 | C14 | C9 | 115.5° | 109.5° |
| C14 | C13 | H13 | 110.1° | 109.5° |
| C14 | C13 | H13A | 110.5° | 109.4° |
| C13 | C14 | H14 | 107.5° | 109.5° |
| C13 | C14 | H14A | 106.1° | 109.5° |
| C3 | C15 | H15 | 109.5° | 109.4° |
| C3 | C15 | H15A | 109.5° | 109.5° |
| C3 | C15 | H15B | 109.5° | 109.5° |
| C15 | C3 | H3 | 107.8° | 109.5° |
| C15 | C3 | H3A | 106.6° | 109.5° |
| C12 | C11 | H11 | 108.8° | 109.4° |
| C12 | C11 | H11A | 108.4° | 109.4° |
| C11 | C12 | H12 | 107.9° | 109.5° |
| C11 | C12 | H12A | 106.8° | 109.4° |
| C9 | C14 | H14 | 107.5° | 109.4° |
| C9 | C14 | H14A | 106.1° | 109.5° |
| C14 | C9 | H9 | 107.6° | 109.4° |
| C14 | C9 | H9A | 106.3° | 109.5° |
| S | C | C2 | 100.3° | 102.4° |
| N | C2 | O | 119.2° | 123.8° |
| N | C2 | C | 118.2° | 112.5° |
| O | C2 | C | 122.6° | 123.7° |
| H5 | C5 | H5A | 109.0° | 109.5° |
| H6 | C6 | H6A | 109.5° | 109.5° |
| H6 | C6 | H6B | 109.5° | 109.5° |
| H6A | C6 | H6B | 109.5° | 109.5° |
| H8 | C8 | H8A | 110.2° | 109.4° |
| H10 | C10 | H10A | 107.8° | 109.5° |
| H13 | C13 | H13A | 108.0° | 109.5° |
| H15 | C15 | H15A | 109.5° | 109.5° |
| H15 | C15 | H15B | 109.4° | 109.5° |
| H15A | C15 | H15B | 109.5° | 109.5° |
| H11 | C11 | H11A | 111.0° | 109.5° |
| H12 | C12 | H12A | 113.3° | 109.5° |
| H14 | C14 | H14A | 114.4° | 109.5° |
| H9 | C9 | H9A | 114.1° | 109.4° |
| H3 | C3 | H3A | 113.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N17 | C4 | S | N | 177.8° | 179.8° |
| C4 | N17 | C7 | C8 | 90.4° | 155.1° |
| C4 | N17 | C7 | C9 | 149.6° | 84.9° |
| C4 | N17 | C7 | HN17 | 180.0° | 179.9° |
| N17 | C4 | S | C | 177.6° | 179.9° |
| N17 | C4 | N | C2 | 178.9° | 179.9° |
| C4 | N17 | C7 | H7 | 32.6° | 35.0° |
| C4 | S | C | C5 | 120.7° | 118.2° |
| C4 | S | C | C6 | 116.0° | 118.4° |
| S | C4 | N17 | C7 | 4.4° | 180.0° |
| S | C4 | N | C2 | 1.0° | 0.2° |
| C4 | S | C | C2 | 1.0° | 0.2° |
| S | C4 | N17 | HN17 | 175.7° | 0.1° |
| N | C4 | N17 | C7 | 178.0° | 0.2° |
| N | C4 | S | C | 0.2° | 0.2° |
| C4 | N | C2 | O | 179.6° | 180.0° |
| C4 | N | C2 | C | 1.9° | 0.1° |
| N | C4 | N17 | HN17 | 2.0° | 179.7° |
| C | C5 | C3 | H5 | 120.0° | 119.9° |
| C | C5 | C3 | H5A | 120.2° | 120.0° |
| C5 | C | C6 | S | 122.5° | 123.4° |
| C5 | C | C6 | C2 | 128.3° | 123.5° |
| C | C5 | C3 | C15 | 167.9° | 180.0° |
| C5 | C | S | C2 | 119.7° | 118.0° |
| C5 | C | C2 | N | 120.3° | 118.2° |
| C5 | C | C2 | O | 62.1° | 61.7° |
| C | C5 | H5 | H5A | 120.2° | 120.0° |
| C5 | C | C6 | H6 | 163.8° | 60.0° |
| C5 | C | C6 | H6A | 43.8° | 179.9° |
| C5 | C | C6 | H6B | 76.2° | 60.0° |
| C | C5 | C3 | H3 | 47.9° | 60.0° |
| C | C5 | C3 | H3A | 74.4° | 60.0° |
| C3 | C5 | C | C6 | 148.8° | 175.0° |
| C5 | C3 | C15 | H3 | 120.0° | 120.0° |
| C5 | C3 | C15 | H3A | 117.7° | 120.0° |
| C3 | C5 | C | S | 28.5° | 61.6° |
| C3 | C5 | C | C2 | 83.4° | 51.3° |
| C3 | C5 | H5 | H5A | 120.3° | 120.0° |
| C5 | C3 | C15 | H15 | 23.5° | 180.0° |
| C5 | C3 | C15 | H15A | 143.5° | 60.0° |
| C5 | C3 | C15 | H15B | 96.5° | 60.0° |
| C5 | C3 | H3 | H3A | 117.9° | 120.0° |
| C6 | C | S | C2 | 117.0° | 118.6° |
| C6 | C | C2 | N | 111.7° | 118.3° |
| C6 | C | C2 | O | 65.9° | 61.9° |
| C6 | C | C5 | H5 | 91.2° | 55.0° |
| C6 | C | C5 | H5A | 28.6° | 65.0° |
| C | C6 | H6 | H6A | 120.0° | 120.0° |
| C | C6 | H6 | H6B | 120.0° | 120.0° |
| C | C6 | H6A | H6B | 120.0° | 120.0° |
| C8 | C7 | C9 | N17 | 114.0° | 120.0° |
| C8 | C7 | C9 | H7 | 123.4° | 120.0° |
| C8 | C7 | N17 | H7 | 123.0° | 120.0° |
| C7 | C8 | C10 | H8 | 120.0° | 120.1° |
| C7 | C8 | C10 | H8A | 119.6° | 120.0° |
| C7 | C8 | C10 | C11 | 112.3° | 76.0° |
| C8 | C7 | C9 | C14 | 37.7° | 44.0° |
| C7 | C8 | H8 | H8A | 119.6° | 120.0° |
| C7 | C8 | C10 | H10 | 127.7° | 164.0° |
| C7 | C8 | C10 | H10A | 8.6° | 44.0° |
| C8 | C7 | C9 | H9 | 157.7° | 164.0° |
| C8 | C7 | C9 | H9A | 79.8° | 76.0° |
| C8 | C7 | N17 | HN17 | 89.6° | 25.0° |
| C9 | C7 | N17 | H7 | 116.9° | 120.0° |
| C9 | C7 | C8 | C10 | 93.8° | 112.9° |
| C7 | C9 | C14 | C13 | 58.0° | 75.9° |
| C7 | C9 | C14 | H9 | 120.0° | 120.0° |
| C7 | C9 | C14 | H9A | 117.4° | 120.0° |
| C9 | C7 | C8 | H8 | 26.2° | 7.1° |
| C9 | C7 | C8 | H8A | 146.6° | 127.1° |
| C7 | C9 | C14 | H14 | 61.9° | 44.1° |
| C7 | C9 | C14 | H14A | 175.3° | 164.1° |
| C7 | C9 | H9 | H9A | 117.7° | 120.0° |
| C9 | C7 | N17 | HN17 | 30.5° | 95.0° |
| N17 | C7 | C8 | C10 | 145.5° | 127.0° |
| N17 | C7 | C9 | C14 | 151.6° | 164.0° |
| N17 | C7 | C8 | H8 | 94.5° | 112.9° |
| N17 | C7 | C8 | H8A | 25.9° | 7.1° |
| N17 | C7 | C9 | H9 | 88.4° | 76.0° |
| N17 | C7 | C9 | H9A | 34.2° | 44.0° |
| C8 | C10 | C11 | H10 | 120.0° | 120.0° |
| C8 | C10 | C11 | H10A | 120.9° | 119.9° |
| C8 | C10 | C11 | C12 | 105.0° | 75.9° |
| C10 | C8 | C7 | H7 | 23.1° | 7.0° |
| C10 | C8 | H8 | H8A | 119.6° | 119.9° |
| C8 | C10 | H10 | H10A | 120.9° | 120.0° |
| C8 | C10 | C11 | H11 | 15.0° | 44.0° |
| C8 | C10 | C11 | H11A | 135.8° | 164.1° |
| C10 | C11 | C12 | C13 | 41.4° | 113.0° |
| C10 | C11 | C12 | H11 | 120.0° | 120.0° |
| C10 | C11 | C12 | H11A | 119.2° | 120.0° |
| C11 | C10 | C8 | H8 | 7.7° | 44.1° |
| C11 | C10 | C8 | H8A | 128.1° | 164.0° |
| C11 | C10 | H10 | H10A | 120.9° | 120.0° |
| C10 | C11 | H11 | H11A | 119.2° | 120.1° |
| C10 | C11 | C12 | H12 | 78.5° | 7.0° |
| C10 | C11 | C12 | H12A | 159.3° | 127.1° |
| C12 | C13 | C14 | H13 | 120.0° | 120.0° |
| C12 | C13 | C14 | H13A | 120.8° | 120.0° |
| C13 | C12 | C11 | H12 | 120.0° | 120.0° |
| C13 | C12 | C11 | H12A | 117.9° | 120.0° |
| C12 | C13 | C14 | C9 | 124.8° | 75.9° |
| C12 | C13 | H13 | H13A | 120.8° | 120.0° |
| C13 | C12 | C11 | H11 | 78.6° | 7.0° |
| C13 | C12 | C11 | H11A | 160.6° | 127.0° |
| C13 | C12 | H12 | H12A | 118.0° | 120.0° |
| C12 | C13 | C14 | H14 | 4.8° | 44.1° |
| C12 | C13 | C14 | H14A | 118.0° | 164.1° |
| C14 | C13 | C12 | C11 | 52.2° | 44.0° |
| C13 | C14 | C9 | H14 | 120.0° | 120.0° |
| C13 | C14 | C9 | H14A | 117.2° | 120.0° |
| C14 | C13 | H13 | H13A | 120.8° | 120.0° |
| C14 | C13 | C12 | H12 | 172.3° | 75.9° |
| C14 | C13 | C12 | H12A | 65.7° | 164.0° |
| C13 | C14 | H14 | H14A | 117.5° | 120.0° |
| C13 | C14 | C9 | H9 | 62.0° | 44.1° |
| C13 | C14 | C9 | H9A | 175.5° | 164.0° |
| C15 | C3 | C5 | H5 | 72.1° | 60.0° |
| C15 | C3 | C5 | H5A | 47.7° | 60.0° |
| C3 | C15 | H15 | H15A | 120.0° | 120.0° |
| C3 | C15 | H15 | H15B | 120.0° | 120.0° |
| C3 | C15 | H15A | H15B | 120.0° | 120.0° |
| C15 | C3 | H3 | H3A | 117.9° | 120.0° |
| C12 | C11 | C10 | H10 | 135.0° | 164.0° |
| C12 | C11 | C10 | H10A | 15.8° | 44.0° |
| C11 | C12 | C13 | H13 | 172.3° | 76.0° |
| C11 | C12 | C13 | H13A | 68.5° | 164.0° |
| C12 | C11 | H11 | H11A | 119.2° | 120.0° |
| C11 | C12 | H12 | H12A | 118.1° | 120.0° |
| C14 | C9 | C7 | H7 | 85.7° | 75.9° |
| C9 | C14 | C13 | H13 | 115.2° | 164.1° |
| C9 | C14 | C13 | H13A | 4.0° | 44.1° |
| C9 | C14 | H14 | H14A | 117.5° | 120.0° |
| C14 | C9 | H9 | H9A | 117.6° | 120.0° |
| S | C | C2 | N | 1.8° | 0.1° |
| S | C | C2 | O | 179.4° | 179.8° |
| S | C | C5 | H5 | 148.6° | 178.4° |
| S | C | C5 | H5A | 91.7° | 58.4° |
| S | C | C6 | H6 | 41.3° | 176.6° |
| S | C | C6 | H6A | 78.7° | 56.6° |
| S | C | C6 | H6B | 161.3° | 63.4° |
| N | C2 | O | C | 177.6° | 179.9° |
| C2 | C | C5 | H5 | 36.6° | 68.7° |
| C2 | C | C5 | H5A | 156.4° | 171.3° |
| C2 | C | C6 | H6 | 67.9° | 63.4° |
| C2 | C | C6 | H6A | 172.1° | 56.6° |
| C2 | C | C6 | H6B | 52.1° | 176.6° |
| H5 | C5 | C3 | H3 | 167.9° | 180.0° |
| H5 | C5 | C3 | H3A | 45.6° | 59.9° |
| H5A | C5 | C3 | H3 | 72.3° | 60.0° |
| H5A | C5 | C3 | H3A | 165.4° | 179.9° |
| H6 | C6 | H6A | H6B | 120.0° | 120.0° |
| H7 | C7 | C8 | H8 | 143.1° | 127.0° |
| H7 | C7 | C8 | H8A | 96.5° | 113.0° |
| H7 | C7 | C9 | H9 | 34.3° | 44.0° |
| H7 | C7 | C9 | H9A | 156.9° | 164.0° |
| H7 | C7 | N17 | HN17 | 147.4° | 145.1° |
| H8 | C8 | C10 | H10 | 112.3° | 75.9° |
| H8 | C8 | C10 | H10A | 128.6° | 164.1° |
| H8A | C8 | C10 | H10 | 8.1° | 44.1° |
| H8A | C8 | C10 | H10A | 111.0° | 76.0° |
| H10 | C10 | C11 | H11 | 105.0° | 76.0° |
| H10 | C10 | C11 | H11A | 15.8° | 44.0° |
| H10A | C10 | C11 | H11 | 135.8° | 164.0° |
| H10A | C10 | C11 | H11A | 103.4° | 76.0° |
| H13 | C13 | C12 | H12 | 67.7° | 164.1° |
| H13 | C13 | C12 | H12A | 54.4° | 44.0° |
| H13 | C13 | C14 | H14 | 124.8° | 76.0° |
| H13 | C13 | C14 | H14A | 2.0° | 44.0° |
| H13A | C13 | C12 | H12 | 51.5° | 44.0° |
| H13A | C13 | C12 | H12A | 173.6° | 76.1° |
| H13A | C13 | C14 | H14 | 116.0° | 164.0° |
| H13A | C13 | C14 | H14A | 121.2° | 76.0° |
| H15 | C15 | H15A | H15B | 120.0° | 120.0° |
| H15 | C15 | C3 | H3 | 96.5° | 60.0° |
| H15 | C15 | C3 | H3A | 141.2° | 60.0° |
| H15A | C15 | C3 | H3 | 23.5° | 180.0° |
| H15A | C15 | C3 | H3A | 98.8° | 59.9° |
| H15B | C15 | C3 | H3 | 143.5° | 60.0° |
| H15B | C15 | C3 | H3A | 21.2° | 180.0° |
| H11 | C11 | C12 | H12 | 161.4° | 127.0° |
| H11 | C11 | C12 | H12A | 39.3° | 112.9° |
| H11A | C11 | C12 | H12 | 40.6° | 113.0° |
| H11A | C11 | C12 | H12A | 81.5° | 7.1° |
| H14 | C14 | C9 | H9 | 178.0° | 164.1° |
| H14 | C14 | C9 | H9A | 55.5° | 76.0° |
| H14A | C14 | C9 | H9 | 55.3° | 76.0° |
| H14A | C14 | C9 | H9A | 67.3° | 44.0° |
