6C4
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C9 | C8 | sing | 1.55Å | 1.51Å | |
| C9 | C10 | sing | 1.55Å | 1.52Å | |
| C8 | C7 | sing | 1.54Å | 1.53Å | |
| C10 | C11 | sing | 1.54Å | 1.52Å | |
| C3 | C4 | sing | 1.55Å | 1.54Å | |
| C3 | C2 | sing | 1.54Å | 1.54Å | |
| C11 | C7 | sing | 1.54Å | 1.53Å | |
| C7 | C6 | sing | 1.53Å | 1.50Å | |
| C4 | C | sing | 1.55Å | 1.53Å | |
| N | C6 | sing | 1.47Å | 1.50Å | |
| N | C5 | sing | 1.35Å | 1.34Å | |
| C2 | C5 | sing | 1.51Å | 1.50Å | |
| C2 | C1 | sing | 1.54Å | 1.52Å | |
| C5 | O | doub | 1.21Å | 1.25Å | |
| C | C1 | sing | 1.54Å | 1.51Å | |
| C2 | H1 | sing | 1.09Å | 1.10Å | |
| C4 | H2 | sing | 1.09Å | 1.10Å | |
| C4 | H3 | sing | 1.09Å | 1.10Å | |
| C6 | H4 | sing | 1.09Å | 1.10Å | |
| C6 | H5 | sing | 1.09Å | 1.10Å | |
| C7 | H6 | sing | 1.09Å | 1.10Å | |
| C9 | H7 | sing | 1.09Å | 1.10Å | |
| C9 | H8 | sing | 1.09Å | 1.10Å | |
| C11 | H9 | sing | 1.09Å | 1.10Å | |
| C11 | H10 | sing | 1.09Å | 1.10Å | |
| C1 | H11 | sing | 1.09Å | 1.10Å | |
| C1 | H12 | sing | 1.09Å | 1.10Å | |
| C3 | H13 | sing | 1.09Å | 1.10Å | |
| C3 | H14 | sing | 1.09Å | 1.10Å | |
| C | H15 | sing | 1.09Å | 1.10Å | |
| C | H16 | sing | 1.09Å | 1.10Å | |
| N | H17 | sing | 0.97Å | 1.00Å | |
| C10 | H18 | sing | 1.09Å | 1.10Å | |
| C10 | H19 | sing | 1.09Å | 1.10Å | |
| C8 | H20 | sing | 1.09Å | 1.10Å | |
| C8 | H21 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C8 | C9 | C10 | 107.7° | 102.8° |
| C9 | C8 | C7 | 100.5° | 104.2° |
| C8 | C9 | H7 | 109.9° | 110.8° |
| C8 | C9 | H8 | 109.9° | 110.8° |
| C9 | C8 | H20 | 111.6° | 110.5° |
| C9 | C8 | H21 | 111.7° | 110.4° |
| C9 | C10 | C11 | 106.9° | 104.2° |
| C10 | C9 | H7 | 109.9° | 110.7° |
| C10 | C9 | H8 | 109.9° | 110.7° |
| C9 | C10 | H18 | 110.1° | 110.5° |
| C9 | C10 | H19 | 110.1° | 110.5° |
| C8 | C7 | C11 | 106.3° | 106.6° |
| C8 | C7 | C6 | 115.1° | 110.0° |
| C8 | C7 | H6 | 105.3° | 110.1° |
| C7 | C8 | H20 | 111.7° | 110.5° |
| C7 | C8 | H21 | 111.7° | 110.5° |
| C10 | C11 | C7 | 103.3° | 106.6° |
| C10 | C11 | H9 | 111.0° | 110.0° |
| C10 | C11 | H10 | 111.0° | 110.1° |
| C11 | C10 | H18 | 110.1° | 110.4° |
| C11 | C10 | H19 | 110.1° | 110.5° |
| C4 | C3 | C2 | 104.5° | 104.2° |
| C3 | C4 | C | 106.1° | 102.8° |
| C3 | C4 | H2 | 110.3° | 110.8° |
| C3 | C4 | H3 | 110.3° | 111.0° |
| C4 | C3 | H13 | 110.7° | 110.5° |
| C4 | C3 | H14 | 110.7° | 110.5° |
| C3 | C2 | C5 | 107.2° | 110.0° |
| C3 | C2 | C1 | 107.5° | 106.6° |
| C3 | C2 | H1 | 110.3° | 110.0° |
| C2 | C3 | H13 | 110.7° | 110.5° |
| C2 | C3 | H14 | 110.7° | 110.6° |
| C11 | C7 | C6 | 118.3° | 110.0° |
| C11 | C7 | H6 | 105.2° | 110.0° |
| C7 | C11 | H9 | 111.0° | 110.0° |
| C7 | C11 | H10 | 111.0° | 110.1° |
| C7 | C6 | N | 114.3° | 109.5° |
| C7 | C6 | H4 | 108.3° | 109.5° |
| C7 | C6 | H5 | 108.3° | 109.5° |
| C6 | C7 | H6 | 105.5° | 110.0° |
| C4 | C | C1 | 108.7° | 104.2° |
| C | C4 | H2 | 110.3° | 110.7° |
| C | C4 | H3 | 110.3° | 110.7° |
| C4 | C | H15 | 109.7° | 110.5° |
| C4 | C | H16 | 109.7° | 110.5° |
| C6 | N | C5 | 117.9° | 120.0° |
| N | C6 | H4 | 108.2° | 109.5° |
| N | C6 | H5 | 108.2° | 109.5° |
| C6 | N | H17 | 121.0° | 119.9° |
| N | C5 | C2 | 116.1° | 120.0° |
| N | C5 | O | 120.7° | 120.0° |
| C5 | N | H17 | 121.0° | 120.0° |
| C5 | C2 | C1 | 110.3° | 110.0° |
| C2 | C5 | O | 123.2° | 120.0° |
| C5 | C2 | H1 | 110.9° | 110.0° |
| C2 | C1 | C | 101.7° | 106.6° |
| C1 | C2 | H1 | 110.6° | 110.0° |
| C2 | C1 | H11 | 111.4° | 110.0° |
| C2 | C1 | H12 | 111.4° | 110.0° |
| C | C1 | H11 | 111.4° | 110.1° |
| C | C1 | H12 | 111.4° | 110.1° |
| C1 | C | H15 | 109.7° | 110.4° |
| C1 | C | H16 | 109.7° | 110.5° |
| H2 | C4 | H3 | 109.5° | 110.6° |
| H4 | C6 | H5 | 109.4° | 109.4° |
| H7 | C9 | H8 | 109.5° | 110.9° |
| H9 | C11 | H10 | 109.5° | 110.0° |
| H11 | C1 | H12 | 109.5° | 110.0° |
| H13 | C3 | H14 | 109.5° | 110.5° |
| H15 | C | H16 | 109.5° | 110.6° |
| H18 | C10 | H19 | 109.4° | 110.5° |
| H20 | C8 | H21 | 109.5° | 110.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C8 | C9 | C10 | H7 | 119.7° | 118.3° |
| C8 | C9 | C10 | H8 | 119.7° | 118.3° |
| C9 | C8 | C7 | H20 | 118.5° | 118.7° |
| C9 | C8 | C7 | H21 | 118.5° | 118.6° |
| C8 | C9 | C10 | C11 | 14.2° | 37.9° |
| C9 | C8 | C7 | C11 | 39.5° | 23.6° |
| C9 | C8 | C7 | C6 | 172.4° | 142.9° |
| C9 | C8 | C7 | H6 | 71.8° | 95.7° |
| C8 | C9 | H7 | H8 | 120.8° | 123.4° |
| C8 | C9 | C10 | H18 | 105.4° | 80.7° |
| C8 | C9 | C10 | H19 | 133.9° | 156.6° |
| C9 | C8 | H20 | H21 | 124.2° | 122.5° |
| C10 | C9 | C8 | C7 | 32.6° | 37.9° |
| C9 | C10 | C11 | H18 | 119.6° | 118.7° |
| C9 | C10 | C11 | H19 | 119.6° | 118.7° |
| C9 | C10 | C11 | C7 | 10.4° | 23.6° |
| C10 | C9 | H7 | H8 | 120.8° | 123.3° |
| C9 | C10 | C11 | H9 | 108.6° | 95.6° |
| C9 | C10 | C11 | H10 | 129.5° | 142.9° |
| C9 | C10 | H18 | H19 | 121.2° | 122.6° |
| C10 | C9 | C8 | H20 | 151.1° | 80.8° |
| C10 | C9 | C8 | H21 | 85.9° | 156.6° |
| C8 | C7 | C11 | C10 | 31.5° | 0.0° |
| C8 | C7 | C11 | C6 | 131.1° | 119.3° |
| C8 | C7 | C11 | H6 | 111.4° | 119.3° |
| C8 | C7 | C6 | H6 | 115.6° | 121.4° |
| C8 | C7 | C6 | N | 36.1° | 67.1° |
| C8 | C7 | C6 | H4 | 84.6° | 52.9° |
| C8 | C7 | C6 | H5 | 156.8° | 172.9° |
| C7 | C8 | C9 | H7 | 152.3° | 80.3° |
| C7 | C8 | C9 | H8 | 87.1° | 156.2° |
| C8 | C7 | C11 | H9 | 87.6° | 119.3° |
| C8 | C7 | C11 | H10 | 150.5° | 119.4° |
| C7 | C8 | H20 | H21 | 124.2° | 122.7° |
| C10 | C11 | C7 | H9 | 119.0° | 119.2° |
| C10 | C11 | C7 | H10 | 119.0° | 119.4° |
| C10 | C11 | C7 | C6 | 162.6° | 119.3° |
| C10 | C11 | C7 | H6 | 79.9° | 119.3° |
| C11 | C10 | C9 | H7 | 133.9° | 80.4° |
| C11 | C10 | C9 | H8 | 105.5° | 156.2° |
| C10 | C11 | H9 | H10 | 122.8° | 121.5° |
| C11 | C10 | H18 | H19 | 121.2° | 122.6° |
| C4 | C3 | C2 | H13 | 119.2° | 118.7° |
| C4 | C3 | C2 | H14 | 119.2° | 118.7° |
| C3 | C4 | C | H2 | 119.5° | 118.3° |
| C3 | C4 | C | H3 | 119.5° | 118.5° |
| C4 | C3 | C2 | C5 | 144.9° | 142.9° |
| C4 | C3 | C2 | C1 | 26.4° | 23.6° |
| C3 | C4 | C | C1 | 14.1° | 37.9° |
| C4 | C3 | C2 | H1 | 94.2° | 95.7° |
| C3 | C4 | H2 | H3 | 121.5° | 123.5° |
| C4 | C3 | H13 | H14 | 122.3° | 122.5° |
| C3 | C4 | C | H15 | 134.0° | 80.7° |
| C3 | C4 | C | H16 | 105.8° | 156.6° |
| C2 | C3 | C4 | C | 7.4° | 37.9° |
| C3 | C2 | C5 | N | 48.9° | 62.8° |
| C3 | C2 | C5 | C1 | 116.7° | 117.2° |
| C3 | C2 | C5 | H1 | 120.4° | 121.4° |
| C3 | C2 | C1 | H1 | 120.4° | 119.3° |
| C3 | C2 | C5 | O | 131.4° | 117.2° |
| C3 | C2 | C1 | C | 34.4° | 0.0° |
| C2 | C3 | C4 | H2 | 126.9° | 156.2° |
| C2 | C3 | C4 | H3 | 112.1° | 80.5° |
| C3 | C2 | C1 | H11 | 153.1° | 119.3° |
| C3 | C2 | C1 | H12 | 84.4° | 119.4° |
| C2 | C3 | H13 | H14 | 122.3° | 122.7° |
| C11 | C7 | C6 | H6 | 117.3° | 121.4° |
| C11 | C7 | C6 | N | 163.1° | 175.7° |
| C11 | C7 | C6 | H4 | 42.4° | 64.3° |
| C11 | C7 | C6 | H5 | 76.2° | 55.7° |
| C7 | C11 | H9 | H10 | 122.9° | 121.4° |
| C7 | C11 | C10 | H18 | 130.1° | 95.1° |
| C7 | C11 | C10 | H19 | 109.2° | 142.3° |
| C11 | C7 | C8 | H20 | 158.0° | 95.0° |
| C11 | C7 | C8 | H21 | 79.0° | 142.2° |
| C7 | C6 | N | H4 | 120.7° | 120.0° |
| C7 | C6 | N | H5 | 120.7° | 120.0° |
| C7 | C6 | N | C5 | 138.8° | 180.0° |
| C7 | C6 | H4 | H5 | 117.8° | 120.0° |
| C6 | C7 | C11 | H9 | 43.6° | 121.4° |
| C6 | C7 | C11 | H10 | 78.4° | 0.1° |
| C7 | C6 | N | H17 | 41.2° | 0.0° |
| C6 | C7 | C8 | H20 | 69.1° | 24.2° |
| C6 | C7 | C8 | H21 | 53.9° | 98.5° |
| C4 | C | C1 | C2 | 29.6° | 23.6° |
| C4 | C | C1 | H15 | 119.9° | 118.6° |
| C4 | C | C1 | H16 | 119.9° | 118.7° |
| C | C4 | H2 | H3 | 121.6° | 123.2° |
| C4 | C | C1 | H11 | 148.3° | 95.6° |
| C4 | C | C1 | H12 | 89.2° | 142.9° |
| C | C4 | C3 | H13 | 126.6° | 80.8° |
| C | C4 | C3 | H14 | 111.8° | 156.7° |
| C4 | C | H15 | H16 | 120.4° | 122.7° |
| C6 | N | C5 | H17 | 180.0° | 180.0° |
| C6 | N | C5 | C2 | 167.8° | 180.0° |
| C6 | N | C5 | O | 11.9° | 0.0° |
| N | C6 | H4 | H5 | 117.8° | 120.0° |
| N | C6 | C7 | H6 | 79.5° | 54.3° |
| N | C5 | C2 | O | 179.7° | 180.0° |
| N | C5 | C2 | C1 | 165.6° | 180.0° |
| N | C5 | C2 | H1 | 71.5° | 58.6° |
| C5 | N | C6 | H4 | 100.4° | 60.0° |
| C5 | N | C6 | H5 | 18.1° | 60.0° |
| C5 | C2 | C1 | H1 | 123.1° | 121.4° |
| C5 | C2 | C1 | C | 150.9° | 119.3° |
| C5 | C2 | C1 | H11 | 90.4° | 121.4° |
| C5 | C2 | C1 | H12 | 32.1° | 0.0° |
| C5 | C2 | C3 | H13 | 95.9° | 24.2° |
| C5 | C2 | C3 | H14 | 25.8° | 98.4° |
| C2 | C5 | N | H17 | 12.2° | 0.0° |
| C1 | C2 | C5 | O | 14.7° | 0.0° |
| C2 | C1 | C | H11 | 118.7° | 119.2° |
| C2 | C1 | C | H12 | 118.8° | 119.3° |
| C2 | C1 | H11 | H12 | 123.6° | 121.4° |
| C1 | C2 | C3 | H13 | 145.6° | 95.1° |
| C1 | C2 | C3 | H14 | 92.8° | 142.3° |
| C2 | C1 | C | H15 | 149.5° | 95.0° |
| C2 | C1 | C | H16 | 90.3° | 142.3° |
| O | C5 | C2 | H1 | 108.2° | 121.4° |
| O | C5 | N | H17 | 168.1° | 180.0° |
| C | C1 | C2 | H1 | 86.0° | 119.3° |
| C1 | C | C4 | H2 | 105.4° | 156.3° |
| C1 | C | C4 | H3 | 133.6° | 80.6° |
| C | C1 | H11 | H12 | 123.6° | 121.5° |
| C1 | C | H15 | H16 | 120.4° | 122.6° |
| H1 | C2 | C1 | H11 | 32.7° | 0.0° |
| H1 | C2 | C1 | H12 | 155.2° | 121.3° |
| H1 | C2 | C3 | H13 | 25.0° | 145.6° |
| H1 | C2 | C3 | H14 | 146.6° | 23.0° |
| H2 | C4 | C3 | H13 | 113.9° | 37.5° |
| H2 | C4 | C3 | H14 | 7.7° | 85.0° |
| H2 | C4 | C | H15 | 14.5° | 37.6° |
| H2 | C4 | C | H16 | 134.7° | 85.1° |
| H3 | C4 | C3 | H13 | 7.1° | 160.8° |
| H3 | C4 | C3 | H14 | 128.7° | 38.3° |
| H3 | C4 | C | H15 | 106.6° | 160.8° |
| H3 | C4 | C | H16 | 13.7° | 38.1° |
| H4 | C6 | C7 | H6 | 159.7° | 174.3° |
| H4 | C6 | N | H17 | 79.6° | 120.0° |
| H5 | C6 | C7 | H6 | 41.2° | 65.7° |
| H5 | C6 | N | H17 | 161.9° | 120.0° |
| H6 | C7 | C11 | H9 | 161.1° | 0.1° |
| H6 | C7 | C11 | H10 | 39.1° | 121.3° |
| H6 | C7 | C8 | H20 | 46.7° | 145.6° |
| H6 | C7 | C8 | H21 | 169.7° | 22.9° |
| H7 | C9 | C10 | H18 | 14.3° | 161.0° |
| H7 | C9 | C10 | H19 | 106.4° | 38.3° |
| H7 | C9 | C8 | H20 | 89.1° | 161.0° |
| H7 | C9 | C8 | H21 | 33.8° | 38.4° |
| H8 | C9 | C10 | H18 | 134.9° | 37.6° |
| H8 | C9 | C10 | H19 | 14.2° | 85.1° |
| H8 | C9 | C8 | H20 | 31.4° | 37.5° |
| H8 | C9 | C8 | H21 | 154.4° | 85.1° |
| H9 | C11 | C10 | H18 | 11.0° | 145.7° |
| H9 | C11 | C10 | H19 | 131.8° | 23.1° |
| H10 | C11 | C10 | H18 | 110.9° | 24.3° |
| H10 | C11 | C10 | H19 | 9.9° | 98.3° |
| H11 | C1 | C | H15 | 91.8° | 145.7° |
| H11 | C1 | C | H16 | 28.5° | 23.1° |
| H12 | C1 | C | H15 | 30.7° | 24.3° |
| H12 | C1 | C | H16 | 151.0° | 98.4° |
