2L7
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C13 | C10 | sing | 1.53Å | 1.49Å | |
| C11 | C10 | sing | 1.53Å | 1.49Å | |
| C10 | C09 | sing | 1.51Å | 1.49Å | |
| C10 | BR1 | sing | 1.97Å | 1.96Å | |
| C09 | N08 | sing | 1.35Å | 1.43Å | |
| C09 | O14 | doub | 1.21Å | 1.23Å | |
| N08 | C07 | sing | 1.40Å | 1.42Å | |
| C06 | C07 | doub | 1.39Å | 1.48Å | Aromatic |
| C06 | C05 | sing | 1.38Å | 1.48Å | Aromatic |
| C07 | C15 | sing | 1.39Å | 1.49Å | Aromatic |
| C05 | C04 | doub | 1.38Å | 1.48Å | Aromatic |
| N01 | C02 | sing | 1.47Å | 1.40Å | |
| C15 | C16 | doub | 1.38Å | 1.48Å | Aromatic |
| C04 | C16 | sing | 1.38Å | 1.48Å | Aromatic |
| C04 | C03 | sing | 1.51Å | 1.48Å | |
| C03 | C02 | sing | 1.53Å | 1.44Å | |
| C02 | C17 | sing | 1.51Å | 1.46Å | |
| O19 | C17 | doub | 1.21Å | 1.25Å | |
| C17 | O18 | sing | 1.34Å | 1.26Å | |
| N01 | H1 | sing | 1.01Å | 1.00Å | |
| N01 | H2 | sing | 1.01Å | 1.00Å | |
| C02 | H4 | sing | 1.09Å | 1.10Å | |
| C03 | H5 | sing | 1.09Å | 1.10Å | |
| C03 | H6 | sing | 1.09Å | 1.10Å | |
| C05 | H7 | sing | 1.08Å | 1.08Å | |
| C06 | H8 | sing | 1.08Å | 1.08Å | |
| N08 | H9 | sing | 0.97Å | 1.00Å | |
| C11 | H10 | sing | 1.09Å | 1.10Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C11 | H12 | sing | 1.09Å | 1.10Å | |
| C13 | H13 | sing | 1.09Å | 1.10Å | |
| C13 | H14 | sing | 1.09Å | 1.10Å | |
| C13 | H15 | sing | 1.09Å | 1.10Å | |
| C15 | H16 | sing | 1.08Å | 1.08Å | |
| C16 | H17 | sing | 1.08Å | 1.08Å | |
| O18 | H18 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C13 | C10 | C11 | 114.0° | 109.4° |
| C13 | C10 | C09 | 113.3° | 109.5° |
| C13 | C10 | BR1 | 107.4° | 109.5° |
| C10 | C13 | H13 | 109.5° | 109.4° |
| C10 | C13 | H14 | 109.5° | 109.5° |
| C10 | C13 | H15 | 109.5° | 109.5° |
| C11 | C10 | C09 | 111.3° | 109.5° |
| C11 | C10 | BR1 | 107.2° | 109.5° |
| C10 | C11 | H10 | 109.5° | 109.4° |
| C10 | C11 | H11 | 109.5° | 109.5° |
| C10 | C11 | H12 | 109.5° | 109.5° |
| C09 | C10 | BR1 | 102.7° | 109.5° |
| C10 | C09 | N08 | 115.5° | 120.0° |
| C10 | C09 | O14 | 120.5° | 120.1° |
| N08 | C09 | O14 | 124.0° | 120.0° |
| C09 | N08 | C07 | 127.1° | 120.0° |
| C09 | N08 | H9 | 116.4° | 120.0° |
| N08 | C07 | C06 | 120.6° | 120.0° |
| N08 | C07 | C15 | 117.9° | 120.1° |
| C07 | N08 | H9 | 116.5° | 119.9° |
| C07 | C06 | C05 | 118.8° | 119.9° |
| C06 | C07 | C15 | 120.6° | 119.9° |
| C07 | C06 | H8 | 120.6° | 120.0° |
| C06 | C05 | C04 | 120.4° | 120.1° |
| C06 | C05 | H7 | 119.8° | 120.0° |
| C05 | C06 | H8 | 120.6° | 120.1° |
| C07 | C15 | C16 | 120.6° | 120.0° |
| C07 | C15 | H16 | 119.7° | 120.0° |
| C05 | C04 | C16 | 121.2° | 120.1° |
| C05 | C04 | C03 | 118.8° | 119.9° |
| C04 | C05 | H7 | 119.8° | 119.9° |
| N01 | C02 | C03 | 111.6° | 109.5° |
| N01 | C02 | C17 | 114.5° | 109.5° |
| C02 | N01 | H1 | 109.5° | 111.0° |
| C02 | N01 | H2 | 109.5° | 111.1° |
| N01 | C02 | H4 | 105.9° | 109.5° |
| C15 | C16 | C04 | 118.3° | 120.1° |
| C16 | C15 | H16 | 119.7° | 120.0° |
| C15 | C16 | H17 | 120.9° | 120.0° |
| C16 | C04 | C03 | 120.0° | 120.0° |
| C04 | C16 | H17 | 120.9° | 119.9° |
| C04 | C03 | C02 | 121.4° | 109.5° |
| C04 | C03 | H5 | 106.4° | 109.5° |
| C04 | C03 | H6 | 106.4° | 109.5° |
| C03 | C02 | C17 | 113.4° | 109.5° |
| C03 | C02 | H4 | 105.4° | 109.5° |
| C02 | C03 | H5 | 106.4° | 109.5° |
| C02 | C03 | H6 | 106.4° | 109.5° |
| C02 | C17 | O19 | 119.3° | 120.0° |
| C02 | C17 | O18 | 121.2° | 120.0° |
| C17 | C02 | H4 | 105.1° | 109.5° |
| O19 | C17 | O18 | 119.5° | 120.0° |
| C17 | O18 | H18 | 109.5° | 116.9° |
| H1 | N01 | H2 | 109.5° | 111.0° |
| H5 | C03 | H6 | 109.4° | 109.5° |
| H10 | C11 | H11 | 109.5° | 109.5° |
| H10 | C11 | H12 | 109.4° | 109.5° |
| H11 | C11 | H12 | 109.5° | 109.5° |
| H13 | C13 | H14 | 109.5° | 109.5° |
| H13 | C13 | H15 | 109.4° | 109.4° |
| H14 | C13 | H15 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C13 | C10 | C11 | C09 | 129.6° | 120.0° |
| C13 | C10 | C11 | BR1 | 118.7° | 120.0° |
| C13 | C10 | C09 | BR1 | 115.5° | 120.0° |
| C13 | C10 | C09 | N08 | 29.4° | 70.0° |
| C13 | C10 | C09 | O14 | 151.4° | 110.0° |
| C13 | C10 | C11 | H10 | 180.0° | 180.0° |
| C13 | C10 | C11 | H11 | 60.0° | 60.1° |
| C13 | C10 | C11 | H12 | 60.0° | 60.0° |
| C10 | C13 | H13 | H14 | 120.0° | 120.0° |
| C10 | C13 | H13 | H15 | 120.0° | 120.0° |
| C10 | C13 | H14 | H15 | 120.0° | 120.1° |
| C11 | C10 | C09 | BR1 | 114.5° | 120.0° |
| C11 | C10 | C09 | N08 | 159.4° | 170.0° |
| C11 | C10 | C09 | O14 | 21.3° | 10.0° |
| C10 | C11 | H10 | H11 | 120.0° | 120.0° |
| C10 | C11 | H10 | H12 | 120.0° | 120.0° |
| C10 | C11 | H11 | H12 | 120.0° | 120.1° |
| C11 | C10 | C13 | H13 | 180.0° | 60.0° |
| C11 | C10 | C13 | H14 | 60.0° | 60.0° |
| C11 | C10 | C13 | H15 | 60.0° | 180.0° |
| C10 | C09 | N08 | O14 | 179.3° | 180.0° |
| C10 | C09 | N08 | C07 | 169.3° | 174.7° |
| C10 | C09 | N08 | H9 | 10.7° | 5.3° |
| C09 | C10 | C11 | H10 | 50.4° | 60.0° |
| C09 | C10 | C11 | H11 | 69.6° | 179.9° |
| C09 | C10 | C11 | H12 | 170.4° | 60.0° |
| C09 | C10 | C13 | H13 | 51.3° | 60.0° |
| C09 | C10 | C13 | H14 | 171.3° | 180.0° |
| C09 | C10 | C13 | H15 | 68.6° | 60.0° |
| BR1 | C10 | C09 | N08 | 86.2° | 50.0° |
| BR1 | C10 | C09 | O14 | 93.1° | 130.0° |
| BR1 | C10 | C11 | H10 | 61.2° | 60.0° |
| BR1 | C10 | C11 | H11 | 178.7° | 59.9° |
| BR1 | C10 | C11 | H12 | 58.7° | 180.0° |
| BR1 | C10 | C13 | H13 | 61.4° | 180.0° |
| BR1 | C10 | C13 | H14 | 58.6° | 60.0° |
| BR1 | C10 | C13 | H15 | 178.7° | 60.0° |
| C09 | N08 | C07 | H9 | 180.0° | 179.9° |
| C09 | N08 | C07 | C06 | 177.2° | 33.3° |
| C09 | N08 | C07 | C15 | 14.1° | 146.6° |
| O14 | C09 | N08 | C07 | 9.9° | 5.2° |
| O14 | C09 | N08 | H9 | 170.1° | 174.7° |
| N08 | C07 | C06 | C15 | 168.4° | 179.9° |
| N08 | C07 | C06 | C05 | 173.3° | 180.0° |
| N08 | C07 | C15 | C16 | 173.3° | 180.0° |
| N08 | C07 | C06 | H8 | 6.7° | 0.0° |
| N08 | C07 | C15 | H16 | 6.7° | 0.0° |
| C07 | C06 | C05 | H8 | 180.0° | 180.0° |
| C07 | C06 | C05 | C04 | 2.6° | 0.0° |
| C06 | C07 | C15 | C16 | 4.6° | 0.1° |
| C07 | C06 | C05 | H7 | 177.4° | 180.0° |
| C06 | C07 | N08 | H9 | 2.8° | 146.8° |
| C06 | C07 | C15 | H16 | 175.4° | 180.0° |
| C05 | C06 | C07 | C15 | 4.8° | 0.0° |
| C06 | C05 | C04 | H7 | 180.0° | 180.0° |
| C06 | C05 | C04 | C16 | 0.0° | 0.0° |
| C06 | C05 | C04 | C03 | 179.2° | 179.8° |
| C07 | C15 | C16 | H16 | 180.0° | 180.0° |
| C07 | C15 | C16 | C04 | 1.9° | 0.1° |
| C15 | C07 | C06 | H8 | 175.1° | 180.0° |
| C15 | C07 | N08 | H9 | 165.9° | 33.3° |
| C07 | C15 | C16 | H17 | 178.1° | 179.8° |
| C05 | C04 | C16 | C15 | 0.3° | 0.1° |
| C05 | C04 | C16 | C03 | 179.3° | 179.8° |
| C05 | C04 | C03 | C02 | 145.1° | 89.8° |
| C05 | C04 | C03 | H5 | 93.2° | 150.2° |
| C05 | C04 | C03 | H6 | 23.4° | 30.2° |
| C04 | C05 | C06 | H8 | 177.4° | 180.0° |
| C05 | C04 | C16 | H17 | 179.7° | 179.8° |
| N01 | C02 | C03 | C04 | 72.8° | 65.0° |
| N01 | C02 | C03 | C17 | 131.1° | 120.0° |
| N01 | C02 | C03 | H4 | 114.4° | 120.0° |
| N01 | C02 | C17 | H4 | 115.7° | 120.0° |
| N01 | C02 | C17 | O19 | 12.7° | 20.0° |
| N01 | C02 | C17 | O18 | 166.7° | 160.0° |
| C02 | N01 | H1 | H2 | 120.0° | 124.0° |
| N01 | C02 | C03 | H5 | 165.5° | 55.0° |
| N01 | C02 | C03 | H6 | 48.9° | 175.0° |
| C15 | C16 | C04 | H17 | 180.0° | 179.7° |
| C15 | C16 | C04 | C03 | 179.6° | 179.7° |
| C16 | C04 | C03 | C02 | 35.6° | 90.0° |
| C16 | C04 | C03 | H5 | 86.0° | 30.0° |
| C16 | C04 | C03 | H6 | 157.3° | 150.0° |
| C16 | C04 | C05 | H7 | 180.0° | 180.0° |
| C04 | C16 | C15 | H16 | 178.1° | 179.9° |
| C04 | C03 | C02 | H5 | 121.6° | 120.0° |
| C04 | C03 | C02 | H6 | 121.7° | 120.0° |
| C04 | C03 | C02 | C17 | 156.1° | 175.0° |
| C04 | C03 | C02 | H4 | 41.6° | 55.0° |
| C04 | C03 | H5 | H6 | 114.6° | 120.0° |
| C03 | C04 | C05 | H7 | 0.8° | 0.2° |
| C03 | C04 | C16 | H17 | 0.4° | 0.0° |
| C03 | C02 | C17 | H4 | 114.6° | 120.0° |
| C03 | C02 | C17 | O19 | 142.3° | 100.0° |
| C03 | C02 | C17 | O18 | 37.1° | 80.0° |
| C03 | C02 | N01 | H1 | 180.0° | 176.0° |
| C03 | C02 | N01 | H2 | 60.0° | 60.0° |
| C02 | C03 | H5 | H6 | 114.6° | 120.0° |
| C02 | C17 | O19 | O18 | 179.4° | 180.0° |
| C17 | C02 | N01 | H1 | 49.4° | 64.0° |
| C17 | C02 | N01 | H2 | 70.6° | 60.0° |
| C17 | C02 | C03 | H5 | 34.4° | 65.0° |
| C17 | C02 | C03 | H6 | 82.2° | 55.0° |
| C02 | C17 | O18 | H18 | 179.3° | 180.0° |
| O19 | C17 | C02 | H4 | 103.1° | 140.0° |
| O19 | C17 | O18 | H18 | 0.0° | 0.0° |
| O18 | C17 | C02 | H4 | 77.5° | 40.0° |
| H1 | N01 | C02 | H4 | 65.9° | 56.0° |
| H2 | N01 | C02 | H4 | 174.1° | 180.0° |
| H4 | C02 | C03 | H5 | 80.1° | 175.0° |
| H4 | C02 | C03 | H6 | 163.3° | 65.0° |
| H7 | C05 | C06 | H8 | 2.6° | 0.0° |
| H10 | C11 | H11 | H12 | 120.0° | 120.0° |
| H13 | C13 | H14 | H15 | 120.0° | 120.0° |
| H16 | C15 | C16 | H17 | 1.9° | 0.3° |
