E0N
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C22 | C21 | sing | 1.53Å | 1.54Å | |
| C22 | C23 | sing | 1.53Å | 1.53Å | |
| C21 | C20 | sing | 1.53Å | 1.56Å | |
| C23 | C24 | sing | 1.53Å | 1.53Å | |
| C24 | C19 | sing | 1.53Å | 1.54Å | |
| C20 | C19 | sing | 1.53Å | 1.56Å | |
| C19 | C15 | sing | 1.53Å | 1.63Å | |
| C15 | N14 | sing | 1.47Å | 1.51Å | |
| C15 | C16 | sing | 1.51Å | 1.56Å | |
| O17 | C16 | doub | 1.21Å | 1.29Å | |
| N14 | C12 | sing | 1.35Å | 1.41Å | |
| C16 | O18 | sing | 1.34Å | 1.29Å | |
| C10 | C11 | sing | 1.55Å | 1.57Å | |
| C10 | C09 | sing | 1.52Å | 1.53Å | |
| C12 | C11 | sing | 1.51Å | 1.57Å | |
| C12 | O13 | doub | 1.21Å | 1.25Å | |
| C08 | C09 | doub | 1.38Å | 1.41Å | Aromatic |
| C08 | C06 | sing | 1.38Å | 1.41Å | Aromatic |
| C11 | N02 | sing | 1.48Å | 1.53Å | |
| C09 | C03 | sing | 1.39Å | 1.43Å | Aromatic |
| CL7 | C06 | sing | 1.74Å | 1.82Å | |
| C06 | C05 | doub | 1.38Å | 1.41Å | Aromatic |
| N02 | C03 | sing | 1.40Å | 1.50Å | |
| N02 | C01 | sing | 1.47Å | 1.51Å | |
| C03 | C04 | doub | 1.39Å | 1.41Å | Aromatic |
| C05 | C04 | sing | 1.38Å | 1.42Å | Aromatic |
| C10 | H102 | sing | 1.09Å | 1.10Å | |
| C10 | H101 | sing | 1.09Å | 1.10Å | |
| C15 | H151 | sing | 1.09Å | 1.10Å | |
| C20 | H202 | sing | 1.09Å | 1.10Å | |
| C20 | H201 | sing | 1.09Å | 1.10Å | |
| C21 | H212 | sing | 1.09Å | 1.10Å | |
| C21 | H211 | sing | 1.09Å | 1.10Å | |
| C22 | H221 | sing | 1.09Å | 1.10Å | |
| C22 | H222 | sing | 1.09Å | 1.10Å | |
| C24 | H241 | sing | 1.09Å | 1.10Å | |
| C24 | H242 | sing | 1.09Å | 1.10Å | |
| C01 | H011 | sing | 1.09Å | 1.10Å | |
| C01 | H012 | sing | 1.09Å | 1.10Å | |
| C01 | H013 | sing | 1.09Å | 1.10Å | |
| C04 | H041 | sing | 1.08Å | 1.08Å | |
| C05 | H051 | sing | 1.08Å | 1.08Å | |
| C08 | H081 | sing | 1.08Å | 1.08Å | |
| C11 | H111 | sing | 1.09Å | 1.10Å | |
| C19 | H191 | sing | 1.09Å | 1.10Å | |
| C23 | H231 | sing | 1.09Å | 1.10Å | |
| C23 | H232 | sing | 1.09Å | 1.10Å | |
| N14 | H141 | sing | 0.97Å | 1.00Å | |
| O18 | H1 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C21 | C22 | C23 | 111.2° | 109.5° |
| C22 | C21 | C20 | 113.5° | 109.5° |
| C22 | C21 | H212 | 108.5° | 109.4° |
| C22 | C21 | H211 | 108.5° | 109.5° |
| C21 | C22 | H221 | 109.0° | 109.5° |
| C21 | C22 | H222 | 109.1° | 109.5° |
| C22 | C23 | C24 | 112.1° | 109.5° |
| C23 | C22 | H221 | 109.0° | 109.5° |
| C23 | C22 | H222 | 109.0° | 109.5° |
| C22 | C23 | H231 | 108.8° | 109.4° |
| C22 | C23 | H232 | 108.8° | 109.5° |
| C21 | C20 | C19 | 115.0° | 109.5° |
| C21 | C20 | H202 | 108.1° | 109.5° |
| C21 | C20 | H201 | 108.1° | 109.5° |
| C20 | C21 | H212 | 108.5° | 109.5° |
| C20 | C21 | H211 | 108.4° | 109.5° |
| C23 | C24 | C19 | 114.9° | 109.4° |
| C23 | C24 | H241 | 108.1° | 109.5° |
| C23 | C24 | H242 | 108.1° | 109.5° |
| C24 | C23 | H231 | 108.8° | 109.5° |
| C24 | C23 | H232 | 108.8° | 109.4° |
| C24 | C19 | C20 | 115.7° | 109.5° |
| C24 | C19 | C15 | 108.4° | 109.5° |
| C19 | C24 | H241 | 108.1° | 109.4° |
| C19 | C24 | H242 | 108.1° | 109.5° |
| C24 | C19 | H191 | 107.4° | 109.5° |
| C20 | C19 | C15 | 111.3° | 109.5° |
| C19 | C20 | H202 | 108.1° | 109.4° |
| C19 | C20 | H201 | 108.1° | 109.5° |
| C20 | C19 | H191 | 107.2° | 109.5° |
| C19 | C15 | N14 | 111.2° | 109.4° |
| C19 | C15 | C16 | 111.0° | 109.5° |
| C19 | C15 | H151 | 106.4° | 109.5° |
| C15 | C19 | H191 | 106.4° | 109.4° |
| N14 | C15 | C16 | 113.1° | 109.5° |
| C15 | N14 | C12 | 123.2° | 120.0° |
| N14 | C15 | H151 | 107.7° | 109.5° |
| C15 | N14 | H141 | 118.4° | 120.0° |
| C15 | C16 | O17 | 118.1° | 120.0° |
| C15 | C16 | O18 | 120.4° | 120.0° |
| C16 | C15 | H151 | 107.2° | 109.5° |
| O17 | C16 | O18 | 121.5° | 120.0° |
| N14 | C12 | C11 | 126.7° | 120.0° |
| N14 | C12 | O13 | 119.6° | 120.0° |
| C12 | N14 | H141 | 118.4° | 120.0° |
| C16 | O18 | H1 | 109.5° | 117.0° |
| C11 | C10 | C09 | 105.7° | 102.8° |
| C10 | C11 | C12 | 115.4° | 110.8° |
| C10 | C11 | N02 | 99.4° | 102.6° |
| C11 | C10 | H102 | 110.4° | 110.7° |
| C11 | C10 | H101 | 110.4° | 110.8° |
| C10 | C11 | H111 | 109.1° | 110.8° |
| C10 | C09 | C08 | 133.5° | 131.5° |
| C10 | C09 | C03 | 106.9° | 108.0° |
| C09 | C10 | H102 | 110.4° | 110.7° |
| C09 | C10 | H101 | 110.4° | 110.7° |
| C11 | C12 | O13 | 113.8° | 120.0° |
| C12 | C11 | N02 | 113.9° | 110.8° |
| C12 | C11 | H111 | 109.1° | 110.8° |
| C09 | C08 | C06 | 119.0° | 120.1° |
| C08 | C09 | C03 | 119.6° | 120.5° |
| C09 | C08 | H081 | 120.5° | 120.0° |
| C08 | C06 | CL7 | 119.4° | 120.1° |
| C08 | C06 | C05 | 122.5° | 119.8° |
| C06 | C08 | H081 | 120.5° | 119.9° |
| C11 | N02 | C03 | 106.3° | 107.8° |
| C11 | N02 | C01 | 109.3° | 111.0° |
| N02 | C11 | H111 | 109.6° | 110.7° |
| C09 | C03 | N02 | 109.3° | 110.9° |
| C09 | C03 | C04 | 120.1° | 119.1° |
| CL7 | C06 | C05 | 118.2° | 120.0° |
| C06 | C05 | C04 | 118.1° | 120.2° |
| C06 | C05 | H051 | 120.9° | 119.8° |
| C03 | N02 | C01 | 111.9° | 111.0° |
| N02 | C03 | C04 | 130.6° | 130.0° |
| N02 | C01 | H011 | 109.5° | 109.5° |
| N02 | C01 | H012 | 109.5° | 109.4° |
| N02 | C01 | H013 | 109.5° | 109.5° |
| C03 | C04 | C05 | 120.6° | 120.2° |
| C03 | C04 | H041 | 119.7° | 119.9° |
| C05 | C04 | H041 | 119.7° | 119.9° |
| C04 | C05 | H051 | 121.0° | 119.9° |
| H102 | C10 | H101 | 109.5° | 110.8° |
| H202 | C20 | H201 | 109.5° | 109.4° |
| H212 | C21 | H211 | 109.4° | 109.4° |
| H221 | C22 | H222 | 109.5° | 109.4° |
| H241 | C24 | H242 | 109.5° | 109.5° |
| H011 | C01 | H012 | 109.4° | 109.5° |
| H011 | C01 | H013 | 109.5° | 109.5° |
| H012 | C01 | H013 | 109.5° | 109.5° |
| H231 | C23 | H232 | 109.4° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C21 | C22 | C23 | H221 | 120.3° | 120.1° |
| C21 | C22 | C23 | H222 | 120.3° | 120.0° |
| C22 | C21 | C20 | H212 | 120.6° | 119.9° |
| C22 | C21 | C20 | H211 | 120.6° | 120.1° |
| C21 | C22 | C23 | C24 | 63.1° | 60.0° |
| C22 | C21 | C20 | C19 | 6.7° | 59.9° |
| C22 | C21 | C20 | H202 | 114.2° | 60.1° |
| C22 | C21 | C20 | H201 | 127.5° | 180.0° |
| C22 | C21 | H212 | H211 | 118.2° | 120.0° |
| C21 | C22 | H221 | H222 | 119.2° | 120.0° |
| C21 | C22 | C23 | H231 | 176.5° | 60.1° |
| C21 | C22 | C23 | H232 | 57.3° | 180.0° |
| C23 | C22 | C21 | C20 | 44.8° | 59.9° |
| C22 | C23 | C24 | H231 | 120.4° | 120.0° |
| C22 | C23 | C24 | H232 | 120.4° | 120.0° |
| C22 | C23 | C24 | C19 | 26.5° | 60.0° |
| C23 | C22 | C21 | H212 | 75.8° | 60.1° |
| C23 | C22 | C21 | H211 | 165.4° | 180.0° |
| C23 | C22 | H221 | H222 | 119.2° | 120.0° |
| C22 | C23 | C24 | H241 | 94.3° | 60.0° |
| C22 | C23 | C24 | H242 | 147.2° | 180.0° |
| C22 | C23 | H231 | H232 | 118.8° | 120.0° |
| C21 | C20 | C19 | C24 | 42.6° | 60.0° |
| C21 | C20 | C19 | H202 | 120.8° | 120.0° |
| C21 | C20 | C19 | H201 | 120.8° | 120.1° |
| C21 | C20 | C19 | C15 | 166.8° | 180.0° |
| C21 | C20 | H202 | H201 | 117.5° | 120.0° |
| C20 | C21 | H212 | H211 | 118.1° | 120.1° |
| C20 | C21 | C22 | H221 | 75.4° | 180.0° |
| C20 | C21 | C22 | H222 | 165.1° | 60.1° |
| C21 | C20 | C19 | H191 | 77.2° | 60.0° |
| C23 | C24 | C19 | H241 | 120.8° | 119.9° |
| C23 | C24 | C19 | H242 | 120.8° | 120.0° |
| C23 | C24 | C19 | C20 | 25.1° | 60.0° |
| C23 | C24 | C19 | C15 | 150.8° | 180.0° |
| C24 | C23 | C22 | H221 | 57.1° | 180.0° |
| C24 | C23 | C22 | H222 | 176.6° | 60.0° |
| C23 | C24 | H241 | H242 | 117.6° | 120.1° |
| C23 | C24 | C19 | H191 | 94.5° | 60.0° |
| C24 | C23 | H231 | H232 | 118.8° | 120.0° |
| C24 | C19 | C20 | C15 | 124.2° | 120.0° |
| C24 | C19 | C20 | H191 | 119.8° | 120.0° |
| C24 | C19 | C15 | H191 | 115.3° | 120.0° |
| C24 | C19 | C15 | N14 | 76.1° | 60.0° |
| C24 | C19 | C15 | C16 | 157.1° | 60.0° |
| C24 | C19 | C15 | H151 | 40.8° | 180.0° |
| C24 | C19 | C20 | H202 | 78.2° | 60.0° |
| C24 | C19 | C20 | H201 | 163.4° | 180.0° |
| C19 | C24 | H241 | H242 | 117.5° | 120.0° |
| C19 | C24 | C23 | H231 | 146.9° | 60.0° |
| C19 | C24 | C23 | H232 | 94.0° | 180.0° |
| C20 | C19 | C15 | H191 | 116.5° | 120.0° |
| C20 | C19 | C15 | N14 | 52.2° | 180.0° |
| C20 | C19 | C15 | C16 | 74.7° | 60.1° |
| C20 | C19 | C15 | H151 | 169.1° | 60.0° |
| C19 | C20 | H202 | H201 | 117.5° | 120.0° |
| C19 | C20 | C21 | H212 | 127.3° | 60.0° |
| C19 | C20 | C21 | H211 | 114.0° | 180.0° |
| C20 | C19 | C24 | H241 | 145.9° | 60.0° |
| C20 | C19 | C24 | H242 | 95.7° | 180.0° |
| C19 | C15 | N14 | C16 | 125.6° | 120.0° |
| C19 | C15 | N14 | H151 | 116.1° | 120.0° |
| C19 | C15 | C16 | H151 | 115.8° | 120.0° |
| C19 | C15 | C16 | O17 | 54.7° | 120.0° |
| C19 | C15 | N14 | C12 | 175.2° | 155.0° |
| C19 | C15 | C16 | O18 | 126.6° | 60.0° |
| C15 | C19 | C20 | H202 | 46.0° | 60.0° |
| C15 | C19 | C20 | H201 | 72.4° | 59.9° |
| C15 | C19 | C24 | H241 | 88.4° | 60.0° |
| C15 | C19 | C24 | H242 | 30.1° | 60.0° |
| C19 | C15 | N14 | H141 | 4.8° | 25.0° |
| N14 | C15 | C16 | H151 | 118.5° | 120.0° |
| N14 | C15 | C16 | O17 | 179.5° | 0.0° |
| C15 | N14 | C12 | H141 | 180.0° | 180.0° |
| N14 | C15 | C16 | O18 | 0.9° | 180.0° |
| C15 | N14 | C12 | C11 | 179.6° | 180.0° |
| C15 | N14 | C12 | O13 | 0.7° | 0.0° |
| N14 | C15 | C19 | H191 | 168.6° | 60.0° |
| C15 | C16 | O17 | O18 | 178.6° | 180.0° |
| C16 | C15 | N14 | C12 | 59.2° | 85.0° |
| C16 | C15 | C19 | H191 | 41.8° | 180.0° |
| C16 | C15 | N14 | H141 | 120.8° | 94.9° |
| C15 | C16 | O18 | H1 | 178.6° | 180.0° |
| O17 | C16 | C15 | H151 | 61.0° | 120.0° |
| O17 | C16 | O18 | H1 | 0.0° | 0.0° |
| N14 | C12 | C11 | C10 | 14.4° | 80.0° |
| N14 | C12 | C11 | O13 | 179.7° | 179.9° |
| N14 | C12 | C11 | N02 | 128.5° | 166.8° |
| C12 | N14 | C15 | H151 | 59.0° | 35.0° |
| N14 | C12 | C11 | H111 | 108.7° | 43.5° |
| O18 | C16 | C15 | H151 | 117.6° | 60.0° |
| C11 | C10 | C09 | H102 | 119.4° | 118.3° |
| C11 | C10 | C09 | H101 | 119.4° | 118.4° |
| C10 | C11 | C12 | N02 | 114.1° | 113.2° |
| C10 | C11 | C12 | H111 | 123.2° | 123.5° |
| C10 | C11 | C12 | O13 | 165.3° | 99.9° |
| C11 | C10 | C09 | C08 | 159.0° | 164.0° |
| C10 | C11 | N02 | H111 | 114.3° | 118.3° |
| C11 | C10 | C09 | C03 | 20.9° | 16.0° |
| C10 | C11 | N02 | C03 | 33.3° | 27.3° |
| C10 | C11 | N02 | C01 | 154.2° | 94.5° |
| C11 | C10 | H102 | H101 | 121.8° | 123.3° |
| C09 | C10 | C11 | C12 | 155.0° | 92.7° |
| C10 | C09 | C08 | C03 | 179.9° | 180.0° |
| C10 | C09 | C08 | C06 | 179.6° | 179.7° |
| C09 | C10 | C11 | N02 | 32.8° | 25.6° |
| C10 | C09 | C03 | N02 | 0.7° | 0.8° |
| C10 | C09 | C03 | C04 | 179.6° | 179.6° |
| C09 | C10 | H102 | H101 | 121.7° | 123.3° |
| C10 | C09 | C08 | H081 | 0.4° | 0.3° |
| C09 | C10 | C11 | H111 | 81.8° | 143.8° |
| C12 | C11 | N02 | H111 | 122.5° | 123.4° |
| C12 | C11 | N02 | C03 | 156.5° | 91.0° |
| C12 | C11 | N02 | C01 | 82.5° | 147.2° |
| C12 | C11 | C10 | H102 | 85.6° | 25.6° |
| C12 | C11 | C10 | H101 | 35.6° | 149.0° |
| C11 | C12 | N14 | H141 | 0.4° | 0.0° |
| O13 | C12 | C11 | N02 | 51.2° | 13.3° |
| O13 | C12 | C11 | H111 | 71.5° | 136.6° |
| O13 | C12 | N14 | H141 | 179.3° | 179.9° |
| C09 | C08 | C06 | H081 | 180.0° | 179.9° |
| C09 | C08 | C06 | CL7 | 179.4° | 179.9° |
| C09 | C08 | C06 | C05 | 0.5° | 0.1° |
| C08 | C09 | C03 | N02 | 179.4° | 179.2° |
| C08 | C09 | C03 | C04 | 0.4° | 0.4° |
| C08 | C09 | C10 | H102 | 39.5° | 45.7° |
| C08 | C09 | C10 | H101 | 81.6° | 77.6° |
| C06 | C08 | C09 | C03 | 0.6° | 0.3° |
| C08 | C06 | CL7 | C05 | 179.9° | 180.0° |
| C08 | C06 | C05 | C04 | 0.4° | 0.0° |
| C08 | C06 | C05 | H051 | 179.6° | 179.9° |
| C11 | N02 | C03 | C09 | 22.6° | 18.4° |
| C11 | N02 | C03 | C01 | 119.3° | 121.8° |
| C11 | N02 | C03 | C04 | 158.5° | 162.1° |
| N02 | C11 | C10 | H102 | 152.2° | 143.9° |
| N02 | C11 | C10 | H101 | 86.6° | 92.8° |
| C11 | N02 | C01 | H011 | 180.0° | 60.0° |
| C11 | N02 | C01 | H012 | 60.0° | 180.0° |
| C11 | N02 | C01 | H013 | 60.0° | 60.0° |
| C09 | C03 | N02 | C04 | 178.8° | 179.5° |
| C09 | C03 | N02 | C01 | 141.9° | 103.4° |
| C09 | C03 | C04 | C05 | 0.3° | 0.2° |
| C03 | C09 | C10 | H102 | 140.4° | 134.3° |
| C03 | C09 | C10 | H101 | 98.5° | 102.4° |
| C09 | C03 | C04 | H041 | 179.7° | 179.8° |
| C03 | C09 | C08 | H081 | 179.5° | 179.7° |
| CL7 | C06 | C05 | C04 | 179.6° | 179.9° |
| CL7 | C06 | C05 | H051 | 0.4° | 0.1° |
| CL7 | C06 | C08 | H081 | 0.6° | 0.0° |
| C06 | C05 | C04 | C03 | 0.2° | 0.0° |
| C06 | C05 | C04 | H051 | 180.0° | 180.0° |
| C06 | C05 | C04 | H041 | 179.8° | 180.0° |
| C05 | C06 | C08 | H081 | 179.5° | 180.0° |
| N02 | C03 | C04 | C05 | 179.0° | 179.3° |
| C03 | N02 | C01 | H011 | 62.5° | 59.9° |
| C03 | N02 | C01 | H012 | 177.5° | 60.0° |
| C03 | N02 | C01 | H013 | 57.5° | 180.0° |
| N02 | C03 | C04 | H041 | 1.0° | 0.7° |
| C03 | N02 | C11 | H111 | 81.0° | 145.6° |
| C01 | N02 | C03 | C04 | 39.2° | 76.1° |
| N02 | C01 | H011 | H012 | 120.0° | 120.0° |
| N02 | C01 | H011 | H013 | 120.0° | 120.0° |
| N02 | C01 | H012 | H013 | 120.0° | 120.0° |
| C01 | N02 | C11 | H111 | 40.0° | 23.8° |
| C03 | C04 | C05 | H041 | 180.0° | 180.0° |
| C03 | C04 | C05 | H051 | 179.8° | 180.0° |
| H102 | C10 | C11 | H111 | 37.6° | 97.8° |
| H101 | C10 | C11 | H111 | 158.8° | 25.5° |
| H151 | C15 | C19 | H191 | 74.4° | 60.0° |
| H151 | C15 | N14 | H141 | 121.0° | 145.0° |
| H202 | C20 | C21 | H212 | 6.5° | 180.0° |
| H202 | C20 | C21 | H211 | 125.2° | 60.0° |
| H202 | C20 | C19 | H191 | 162.0° | 179.9° |
| H201 | C20 | C21 | H212 | 111.9° | 60.1° |
| H201 | C20 | C21 | H211 | 6.8° | 59.9° |
| H201 | C20 | C19 | H191 | 43.6° | 60.0° |
| H212 | C21 | C22 | H221 | 163.9° | 60.0° |
| H212 | C21 | C22 | H222 | 44.4° | 180.0° |
| H211 | C21 | C22 | H221 | 45.1° | 59.9° |
| H211 | C21 | C22 | H222 | 74.4° | 60.0° |
| H221 | C22 | C23 | H231 | 63.3° | 60.0° |
| H221 | C22 | C23 | H232 | 177.6° | 60.0° |
| H222 | C22 | C23 | H231 | 56.2° | 179.9° |
| H222 | C22 | C23 | H232 | 63.0° | 60.0° |
| H241 | C24 | C19 | H191 | 26.2° | 180.0° |
| H241 | C24 | C23 | H231 | 26.1° | 180.0° |
| H241 | C24 | C23 | H232 | 145.2° | 60.0° |
| H242 | C24 | C19 | H191 | 144.7° | 60.0° |
| H242 | C24 | C23 | H231 | 92.4° | 60.0° |
| H242 | C24 | C23 | H232 | 26.8° | 60.0° |
| H011 | C01 | H012 | H013 | 120.0° | 120.0° |
| H041 | C04 | C05 | H051 | 0.2° | 0.0° |
