Z14
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N01 | C11 | sing | 1.39Å | 1.32Å | |
| N01 | C16 | sing | 1.47Å | 1.51Å | |
| N01 | HN01 | sing | 0.97Å | 1.00Å | |
| N02 | C15 | sing | 1.35Å | 1.37Å | |
| N02 | HN02 | sing | 0.97Å | 1.00Å | |
| N02 | HN0A | sing | 0.97Å | 1.00Å | |
| N03 | C18 | doub | 1.32Å | 1.37Å | Aromatic |
| N03 | C19 | sing | 1.32Å | 1.36Å | Aromatic |
| N04 | C19 | doub | 1.33Å | 1.37Å | Aromatic |
| N04 | C20 | sing | 1.32Å | 1.37Å | Aromatic |
| N05 | C13 | sing | 1.39Å | 1.33Å | |
| N05 | C21 | sing | 1.47Å | 1.51Å | |
| N05 | C23 | sing | 1.47Å | 1.50Å | |
| N06 | C25 | sing | 1.47Å | 1.45Å | |
| N06 | HN06 | sing | 1.01Å | 1.00Å | |
| N06 | HN0B | sing | 1.01Å | 1.00Å | |
| N07 | C19 | sing | 1.38Å | 1.27Å | |
| N07 | HN07 | sing | 0.97Å | 1.00Å | |
| N07 | HN0C | sing | 0.97Å | 1.00Å | |
| N08 | C14 | sing | 1.48Å | 1.30Å | |
| N08 | O27 | doub | 1.22Å | 1.31Å | |
| N08 | O28 | sing | 1.22Å | 1.32Å | |
| C09 | C10 | doub | 1.40Å | 1.43Å | Aromatic |
| C09 | C14 | sing | 1.36Å | 1.43Å | Aromatic |
| C09 | H09 | sing | 1.08Å | 1.08Å | |
| C10 | C11 | sing | 1.41Å | 1.44Å | Aromatic |
| C10 | C15 | sing | 1.47Å | 1.40Å | |
| C11 | C12 | doub | 1.39Å | 1.44Å | Aromatic |
| C12 | C13 | sing | 1.39Å | 1.43Å | Aromatic |
| C12 | H12 | sing | 1.08Å | 1.08Å | |
| C13 | C14 | doub | 1.39Å | 1.47Å | Aromatic |
| C15 | O26 | doub | 1.22Å | 1.23Å | |
| C16 | C17 | sing | 1.51Å | 1.52Å | |
| C16 | H16 | sing | 1.09Å | 1.10Å | |
| C16 | H16A | sing | 1.09Å | 1.10Å | |
| C17 | C18 | sing | 1.39Å | 1.40Å | Aromatic |
| C17 | C20 | doub | 1.39Å | 1.40Å | Aromatic |
| C18 | H18 | sing | 1.08Å | 1.08Å | |
| C20 | H20 | sing | 1.08Å | 1.08Å | |
| C21 | C22 | sing | 1.53Å | 1.54Å | |
| C21 | H21 | sing | 1.09Å | 1.10Å | |
| C21 | H21A | sing | 1.09Å | 1.10Å | |
| C22 | C25 | sing | 1.53Å | 1.53Å | |
| C22 | H22 | sing | 1.09Å | 1.10Å | |
| C22 | H22A | sing | 1.09Å | 1.10Å | |
| C23 | C24 | sing | 1.53Å | 1.54Å | |
| C23 | H23 | sing | 1.09Å | 1.10Å | |
| C23 | H23A | sing | 1.09Å | 1.10Å | |
| C24 | C25 | sing | 1.53Å | 1.53Å | |
| C24 | H24 | sing | 1.09Å | 1.10Å | |
| C24 | H24A | sing | 1.09Å | 1.10Å | |
| C25 | H25 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C11 | N01 | C16 | 125.0° | 120.0° |
| C11 | N01 | HN01 | 104.6° | 120.1° |
| N01 | C11 | C10 | 119.9° | 120.2° |
| N01 | C11 | C12 | 121.6° | 120.2° |
| C16 | N01 | HN01 | 104.6° | 120.0° |
| N01 | C16 | C17 | 110.2° | 109.5° |
| N01 | C16 | H16 | 109.2° | 109.4° |
| N01 | C16 | H16A | 109.2° | 109.5° |
| C15 | N02 | HN02 | 120.0° | 120.0° |
| C15 | N02 | HN0A | 120.0° | 120.0° |
| N02 | C15 | C10 | 120.0° | 120.0° |
| N02 | C15 | O26 | 118.4° | 120.0° |
| HN02 | N02 | HN0A | 120.0° | 120.1° |
| C18 | N03 | C19 | 115.9° | 120.7° |
| N03 | C18 | C17 | 123.9° | 119.2° |
| N03 | C18 | H18 | 118.1° | 120.4° |
| N03 | C19 | N04 | 125.3° | 121.6° |
| N03 | C19 | N07 | 117.3° | 119.2° |
| C19 | N04 | C20 | 116.3° | 120.7° |
| N04 | C19 | N07 | 117.4° | 119.2° |
| N04 | C20 | C17 | 123.6° | 119.2° |
| N04 | C20 | H20 | 118.2° | 120.4° |
| C13 | N05 | C21 | 118.3° | 111.0° |
| C13 | N05 | C23 | 121.0° | 111.0° |
| N05 | C13 | C12 | 117.3° | 119.9° |
| N05 | C13 | C14 | 124.6° | 119.8° |
| C21 | N05 | C23 | 120.1° | 111.2° |
| N05 | C21 | C22 | 113.7° | 109.5° |
| N05 | C21 | H21 | 108.1° | 109.5° |
| N05 | C21 | H21A | 108.1° | 109.5° |
| N05 | C23 | C24 | 113.9° | 109.5° |
| N05 | C23 | H23 | 108.0° | 109.4° |
| N05 | C23 | H23A | 108.0° | 109.4° |
| C25 | N06 | HN06 | 109.5° | 111.0° |
| C25 | N06 | HN0B | 109.5° | 110.9° |
| N06 | C25 | C22 | 108.9° | 109.5° |
| N06 | C25 | C24 | 108.8° | 109.6° |
| N06 | C25 | H25 | 110.7° | 109.5° |
| HN06 | N06 | HN0B | 109.5° | 110.9° |
| C19 | N07 | HN07 | 109.5° | 120.0° |
| C19 | N07 | HN0C | 109.5° | 120.0° |
| HN07 | N07 | HN0C | 109.5° | 120.0° |
| C14 | N08 | O27 | 121.8° | 120.0° |
| C14 | N08 | O28 | 120.3° | 120.0° |
| N08 | C14 | C09 | 117.4° | 119.8° |
| N08 | C14 | C13 | 124.3° | 119.8° |
| O27 | N08 | O28 | 117.7° | 120.1° |
| C10 | C09 | C14 | 122.8° | 120.2° |
| C10 | C09 | H09 | 118.6° | 119.9° |
| C09 | C10 | C11 | 119.2° | 119.7° |
| C09 | C10 | C15 | 118.5° | 120.2° |
| C14 | C09 | H09 | 118.6° | 119.9° |
| C09 | C14 | C13 | 118.3° | 120.4° |
| C11 | C10 | C15 | 122.2° | 120.1° |
| C10 | C11 | C12 | 118.5° | 119.6° |
| C10 | C15 | O26 | 121.6° | 120.0° |
| C11 | C12 | C13 | 122.9° | 119.9° |
| C11 | C12 | H12 | 118.5° | 120.0° |
| C13 | C12 | H12 | 118.5° | 120.1° |
| C12 | C13 | C14 | 118.1° | 120.3° |
| C17 | C16 | H16 | 109.2° | 109.5° |
| C17 | C16 | H16A | 109.3° | 109.5° |
| C16 | C17 | C18 | 122.1° | 120.8° |
| C16 | C17 | C20 | 122.8° | 120.7° |
| H16 | C16 | H16A | 109.7° | 109.5° |
| C18 | C17 | C20 | 115.1° | 118.6° |
| C17 | C18 | H18 | 118.1° | 120.4° |
| C17 | C20 | H20 | 118.2° | 120.4° |
| C22 | C21 | H21 | 108.1° | 109.4° |
| C22 | C21 | H21A | 108.1° | 109.5° |
| C21 | C22 | C25 | 110.3° | 109.3° |
| C21 | C22 | H22 | 109.2° | 109.6° |
| C21 | C22 | H22A | 109.2° | 109.5° |
| H21 | C21 | H21A | 110.8° | 109.5° |
| C25 | C22 | H22 | 109.2° | 109.5° |
| C25 | C22 | H22A | 109.2° | 109.5° |
| C22 | C25 | C24 | 110.5° | 109.2° |
| C22 | C25 | H25 | 109.0° | 109.5° |
| H22 | C22 | H22A | 109.8° | 109.5° |
| C24 | C23 | H23 | 108.0° | 109.5° |
| C24 | C23 | H23A | 108.0° | 109.5° |
| C23 | C24 | C25 | 111.6° | 109.3° |
| C23 | C24 | H24 | 108.8° | 109.5° |
| C23 | C24 | H24A | 108.8° | 109.5° |
| H23 | C23 | H23A | 110.9° | 109.5° |
| C25 | C24 | H24 | 108.8° | 109.5° |
| C25 | C24 | H24A | 108.8° | 109.5° |
| C24 | C25 | H25 | 109.1° | 109.6° |
| H24 | C24 | H24A | 110.2° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C11 | N01 | C16 | HN01 | 120.0° | 179.7° |
| N01 | C11 | C10 | C09 | 179.6° | 180.0° |
| N01 | C11 | C10 | C12 | 179.4° | 180.0° |
| N01 | C11 | C10 | C15 | 0.2° | 0.0° |
| N01 | C11 | C12 | C13 | 180.0° | 180.0° |
| N01 | C11 | C12 | H12 | 0.0° | 0.0° |
| C11 | N01 | C16 | C17 | 84.0° | 180.0° |
| C11 | N01 | C16 | H16 | 156.0° | 60.0° |
| C11 | N01 | C16 | H16A | 36.0° | 59.9° |
| C16 | N01 | C11 | C10 | 166.2° | 174.4° |
| C16 | N01 | C11 | C12 | 14.4° | 5.6° |
| N01 | C16 | C17 | H16 | 120.0° | 119.9° |
| N01 | C16 | C17 | H16A | 120.0° | 120.0° |
| N01 | C16 | H16 | H16A | 119.7° | 119.9° |
| N01 | C16 | C17 | C18 | 125.8° | 89.9° |
| N01 | C16 | C17 | C20 | 53.5° | 90.0° |
| HN01 | N01 | C11 | C10 | 73.8° | 5.9° |
| HN01 | N01 | C11 | C12 | 105.6° | 174.1° |
| HN01 | N01 | C16 | C17 | 36.0° | 0.3° |
| HN01 | N01 | C16 | H16 | 84.0° | 120.3° |
| HN01 | N01 | C16 | H16A | 156.0° | 119.8° |
| C15 | N02 | HN02 | HN0A | 180.0° | 179.9° |
| N02 | C15 | C10 | C09 | 27.3° | 5.9° |
| N02 | C15 | C10 | C11 | 152.6° | 174.1° |
| N02 | C15 | C10 | O26 | 178.9° | 179.9° |
| HN02 | N02 | C15 | C10 | 178.9° | 0.1° |
| HN02 | N02 | C15 | O26 | 0.0° | 180.0° |
| HN0A | N02 | C15 | C10 | 1.1° | 180.0° |
| HN0A | N02 | C15 | O26 | 180.0° | 0.1° |
| C18 | N03 | C19 | N04 | 0.2° | 0.0° |
| C18 | N03 | C19 | N07 | 179.8° | 180.0° |
| N03 | C18 | C17 | C16 | 179.3° | 180.0° |
| N03 | C18 | C17 | H18 | 180.0° | 179.9° |
| N03 | C18 | C17 | C20 | 0.1° | 0.0° |
| N03 | C19 | N04 | N07 | 179.9° | 180.0° |
| N03 | C19 | N04 | C20 | 0.2° | 0.0° |
| N03 | C19 | N07 | HN07 | 0.0° | 0.0° |
| N03 | C19 | N07 | HN0C | 120.0° | 180.0° |
| C19 | N03 | C18 | C17 | 0.0° | 0.0° |
| C19 | N03 | C18 | H18 | 180.0° | 180.0° |
| N04 | C19 | N07 | HN07 | 179.9° | 180.0° |
| N04 | C19 | N07 | HN0C | 59.9° | 0.1° |
| C19 | N04 | C20 | C17 | 0.0° | 0.0° |
| C19 | N04 | C20 | H20 | 180.0° | 179.9° |
| C20 | N04 | C19 | N07 | 179.8° | 180.0° |
| N04 | C20 | C17 | C16 | 179.3° | 179.9° |
| N04 | C20 | C17 | C18 | 0.1° | 0.0° |
| N04 | C20 | C17 | H20 | 180.0° | 179.9° |
| C13 | N05 | C21 | C23 | 170.9° | 124.0° |
| N05 | C13 | C14 | N08 | 1.6° | 0.0° |
| N05 | C13 | C14 | C09 | 178.2° | 179.9° |
| N05 | C13 | C12 | C11 | 178.8° | 180.0° |
| N05 | C13 | C12 | C14 | 179.3° | 180.0° |
| N05 | C13 | C12 | H12 | 1.2° | 0.0° |
| C13 | N05 | C21 | C22 | 155.2° | 174.2° |
| C13 | N05 | C21 | H21 | 35.2° | 54.2° |
| C13 | N05 | C21 | H21A | 84.8° | 65.8° |
| C13 | N05 | C23 | C24 | 157.3° | 174.2° |
| C13 | N05 | C23 | H23 | 82.7° | 65.8° |
| C13 | N05 | C23 | H23A | 37.3° | 54.2° |
| C21 | N05 | C13 | C12 | 124.1° | 60.0° |
| C21 | N05 | C13 | C14 | 55.1° | 120.0° |
| N05 | C21 | C22 | H21 | 120.0° | 120.0° |
| N05 | C21 | C22 | H21A | 120.0° | 120.0° |
| N05 | C21 | H21 | H21A | 118.3° | 120.0° |
| N05 | C21 | C22 | C25 | 47.2° | 59.2° |
| N05 | C21 | C22 | H22 | 72.8° | 60.8° |
| N05 | C21 | C22 | H22A | 167.2° | 179.1° |
| C21 | N05 | C23 | C24 | 32.0° | 61.8° |
| C21 | N05 | C23 | H23 | 88.0° | 58.3° |
| C21 | N05 | C23 | H23A | 152.0° | 178.3° |
| C23 | N05 | C13 | C12 | 46.7° | 64.2° |
| C23 | N05 | C13 | C14 | 134.1° | 115.8° |
| C23 | N05 | C21 | C22 | 33.8° | 61.8° |
| C23 | N05 | C21 | H21 | 153.8° | 178.2° |
| C23 | N05 | C21 | H21A | 86.1° | 58.2° |
| N05 | C23 | C24 | H23 | 120.0° | 120.0° |
| N05 | C23 | C24 | H23A | 120.0° | 119.9° |
| N05 | C23 | H23 | H23A | 118.2° | 119.9° |
| N05 | C23 | C24 | C25 | 43.9° | 59.2° |
| N05 | C23 | C24 | H24 | 163.9° | 179.2° |
| N05 | C23 | C24 | H24A | 76.1° | 60.8° |
| C25 | N06 | HN06 | HN0B | 120.0° | 123.9° |
| N06 | C25 | C22 | C21 | 179.3° | 177.6° |
| N06 | C25 | C22 | C24 | 119.4° | 120.0° |
| N06 | C25 | C22 | H25 | 120.8° | 120.1° |
| N06 | C25 | C22 | H22 | 60.7° | 57.6° |
| N06 | C25 | C22 | H22A | 59.3° | 62.5° |
| N06 | C25 | C24 | C23 | 179.4° | 177.6° |
| N06 | C25 | C24 | H25 | 120.8° | 120.1° |
| N06 | C25 | C24 | H24 | 60.6° | 62.4° |
| N06 | C25 | C24 | H24A | 59.4° | 57.6° |
| HN06 | N06 | C25 | C22 | 180.0° | 180.0° |
| HN06 | N06 | C25 | C24 | 59.6° | 60.2° |
| HN06 | N06 | C25 | H25 | 60.3° | 59.9° |
| HN0B | N06 | C25 | C22 | 60.0° | 56.1° |
| HN0B | N06 | C25 | C24 | 60.4° | 63.6° |
| HN0B | N06 | C25 | H25 | 179.8° | 176.2° |
| C19 | N07 | HN07 | HN0C | 120.0° | 180.0° |
| C14 | N08 | O27 | O28 | 175.8° | 179.9° |
| N08 | C14 | C09 | C10 | 179.6° | 180.0° |
| N08 | C14 | C09 | C13 | 179.9° | 180.0° |
| N08 | C14 | C09 | H09 | 0.5° | 0.3° |
| N08 | C14 | C13 | C12 | 179.2° | 180.0° |
| O27 | N08 | C14 | C09 | 150.6° | 0.1° |
| O27 | N08 | C14 | C13 | 29.6° | 179.9° |
| O28 | N08 | C14 | C09 | 25.1° | 180.0° |
| O28 | N08 | C14 | C13 | 154.7° | 0.0° |
| C10 | C09 | C14 | H09 | 180.0° | 179.7° |
| C09 | C10 | C11 | C15 | 179.8° | 179.9° |
| C09 | C10 | C11 | C12 | 0.9° | 0.0° |
| C10 | C09 | C14 | C13 | 0.6° | 0.1° |
| C09 | C10 | C15 | O26 | 151.6° | 174.1° |
| C14 | C09 | C10 | C11 | 0.4° | 0.0° |
| C14 | C09 | C10 | C15 | 179.8° | 180.0° |
| C09 | C14 | C13 | C12 | 1.0° | 0.1° |
| H09 | C09 | C10 | C11 | 179.6° | 179.7° |
| H09 | C09 | C10 | C15 | 0.2° | 0.3° |
| H09 | C09 | C14 | C13 | 179.4° | 179.7° |
| C10 | C11 | C12 | C13 | 0.5° | 0.0° |
| C10 | C11 | C12 | H12 | 179.4° | 180.0° |
| C11 | C10 | C15 | O26 | 28.5° | 5.8° |
| C15 | C10 | C11 | C12 | 179.2° | 180.0° |
| C11 | C12 | C13 | H12 | 180.0° | 179.9° |
| C11 | C12 | C13 | C14 | 0.4° | 0.0° |
| H12 | C12 | C13 | C14 | 179.6° | 180.0° |
| C17 | C16 | H16 | H16A | 119.7° | 120.1° |
| C16 | C17 | C18 | C20 | 179.4° | 179.9° |
| C16 | C17 | C18 | H18 | 0.7° | 0.1° |
| C16 | C17 | C20 | H20 | 0.7° | 0.0° |
| H16 | C16 | C17 | C18 | 114.2° | 30.0° |
| H16 | C16 | C17 | C20 | 66.5° | 150.1° |
| H16A | C16 | C17 | C18 | 5.8° | 150.0° |
| H16A | C16 | C17 | C20 | 173.5° | 30.0° |
| C18 | C17 | C20 | H20 | 179.9° | 179.9° |
| C20 | C17 | C18 | H18 | 179.9° | 180.0° |
| C22 | C21 | H21 | H21A | 118.3° | 120.0° |
| C21 | C22 | C25 | H22 | 120.0° | 120.0° |
| C21 | C22 | C25 | H22A | 120.0° | 119.9° |
| C21 | C22 | H22 | H22A | 119.7° | 120.1° |
| C21 | C22 | C25 | C24 | 61.3° | 57.6° |
| C21 | C22 | C25 | H25 | 58.5° | 62.3° |
| H21 | C21 | C22 | C25 | 167.2° | 179.2° |
| H21 | C21 | C22 | H22 | 47.2° | 59.2° |
| H21 | C21 | C22 | H22A | 72.8° | 60.9° |
| H21A | C21 | C22 | C25 | 72.8° | 60.8° |
| H21A | C21 | C22 | H22 | 167.2° | 179.2° |
| H21A | C21 | C22 | H22A | 47.2° | 59.1° |
| C25 | C22 | H22 | H22A | 119.6° | 120.0° |
| C22 | C25 | C24 | C23 | 60.0° | 57.7° |
| C22 | C25 | C24 | H25 | 119.8° | 119.9° |
| C22 | C25 | C24 | H24 | 180.0° | 177.6° |
| C22 | C25 | C24 | H24A | 60.0° | 62.3° |
| H22 | C22 | C25 | C24 | 58.7° | 62.4° |
| H22 | C22 | C25 | H25 | 178.5° | 177.7° |
| H22A | C22 | C25 | C24 | 178.6° | 177.5° |
| H22A | C22 | C25 | H25 | 61.5° | 57.6° |
| C24 | C23 | H23 | H23A | 118.2° | 120.0° |
| C23 | C24 | C25 | H24 | 120.0° | 120.0° |
| C23 | C24 | C25 | H24A | 120.0° | 120.0° |
| C23 | C24 | H24 | H24A | 119.1° | 120.1° |
| C23 | C24 | C25 | H25 | 59.8° | 62.3° |
| H23 | C23 | C24 | C25 | 76.0° | 60.8° |
| H23 | C23 | C24 | H24 | 44.0° | 59.1° |
| H23 | C23 | C24 | H24A | 164.0° | 179.2° |
| H23A | C23 | C24 | C25 | 164.0° | 179.1° |
| H23A | C23 | C24 | H24 | 76.0° | 60.9° |
| H23A | C23 | C24 | H24A | 44.0° | 59.2° |
| C25 | C24 | H24 | H24A | 119.2° | 120.1° |
| H24 | C24 | C25 | H25 | 60.2° | 57.7° |
| H24A | C24 | C25 | H25 | 179.8° | 177.7° |
