HNO
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CL1 | C23 | sing | 1.74Å | 1.79Å | |
| C23 | C22 | doub | 1.36Å | 1.39Å | Aromatic |
| C23 | C24 | sing | 1.40Å | 1.40Å | Aromatic |
| CL2 | C24 | sing | 1.74Å | 1.78Å | |
| C22 | C21 | sing | 1.40Å | 1.43Å | Aromatic |
| C24 | C25 | doub | 1.36Å | 1.39Å | Aromatic |
| C21 | N13 | doub | 1.34Å | 1.36Å | Aromatic |
| C21 | C20 | sing | 1.42Å | 1.36Å | Aromatic |
| C25 | C20 | sing | 1.40Å | 1.43Å | Aromatic |
| N13 | C12 | sing | 1.31Å | 1.33Å | Aromatic |
| C20 | N28 | doub | 1.34Å | 1.37Å | Aromatic |
| C12 | C14 | doub | 1.41Å | 1.40Å | Aromatic |
| N28 | C14 | sing | 1.32Å | 1.33Å | Aromatic |
| C14 | N15 | sing | 1.39Å | 1.46Å | |
| N15 | C16 | sing | 1.46Å | 1.46Å | |
| C19 | C16 | sing | 1.53Å | 1.53Å | |
| C16 | C17 | sing | 1.53Å | 1.53Å | |
| C16 | C18 | sing | 1.53Å | 1.53Å | |
| C12 | H1 | sing | 1.08Å | 1.08Å | |
| C17 | H2 | sing | 1.09Å | 1.10Å | |
| C17 | H3 | sing | 1.09Å | 1.10Å | |
| C17 | H4 | sing | 1.09Å | 1.10Å | |
| C18 | H5 | sing | 1.09Å | 1.10Å | |
| C18 | H6 | sing | 1.09Å | 1.10Å | |
| C18 | H7 | sing | 1.09Å | 1.10Å | |
| C19 | H8 | sing | 1.09Å | 1.10Å | |
| C19 | H9 | sing | 1.09Å | 1.10Å | |
| C19 | H10 | sing | 1.09Å | 1.10Å | |
| C22 | H11 | sing | 1.08Å | 1.08Å | |
| C25 | H12 | sing | 1.08Å | 1.08Å | |
| N15 | H13 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CL1 | C23 | C22 | 119.9° | 119.5° |
| CL1 | C23 | C24 | 120.0° | 119.6° |
| C22 | C23 | C24 | 120.1° | 120.9° |
| C23 | C22 | C21 | 120.0° | 119.8° |
| C23 | C22 | H11 | 120.0° | 120.1° |
| C23 | C24 | CL2 | 120.1° | 119.5° |
| C23 | C24 | C25 | 119.8° | 120.9° |
| CL2 | C24 | C25 | 120.1° | 119.6° |
| C22 | C21 | N13 | 121.5° | 121.0° |
| C22 | C21 | C20 | 120.0° | 119.3° |
| C21 | C22 | H11 | 120.0° | 120.1° |
| C24 | C25 | C20 | 120.1° | 119.8° |
| C24 | C25 | H12 | 120.0° | 120.1° |
| N13 | C21 | C20 | 118.5° | 119.7° |
| C21 | N13 | C12 | 120.8° | 119.8° |
| C21 | C20 | C25 | 120.0° | 119.3° |
| C21 | C20 | N28 | 120.9° | 119.7° |
| C25 | C20 | N28 | 119.1° | 121.0° |
| C20 | C25 | H12 | 120.0° | 120.1° |
| N13 | C12 | C14 | 120.6° | 120.7° |
| N13 | C12 | H1 | 119.7° | 119.7° |
| C20 | N28 | C14 | 120.8° | 119.7° |
| C12 | C14 | N28 | 118.4° | 120.5° |
| C12 | C14 | N15 | 119.3° | 119.8° |
| C14 | C12 | H1 | 119.7° | 119.7° |
| N28 | C14 | N15 | 122.3° | 119.8° |
| C14 | N15 | C16 | 124.6° | 120.0° |
| C14 | N15 | H13 | 105.6° | 120.0° |
| N15 | C16 | C19 | 111.6° | 109.5° |
| N15 | C16 | C17 | 109.9° | 109.5° |
| N15 | C16 | C18 | 108.1° | 109.5° |
| C16 | N15 | H13 | 105.5° | 120.0° |
| C19 | C16 | C17 | 110.1° | 109.4° |
| C19 | C16 | C18 | 108.2° | 109.5° |
| C16 | C19 | H8 | 109.5° | 109.5° |
| C16 | C19 | H9 | 109.5° | 109.5° |
| C16 | C19 | H10 | 109.5° | 109.5° |
| C17 | C16 | C18 | 108.9° | 109.5° |
| C16 | C17 | H2 | 109.5° | 109.4° |
| C16 | C17 | H3 | 109.5° | 109.5° |
| C16 | C17 | H4 | 109.5° | 109.5° |
| C16 | C18 | H5 | 109.5° | 109.5° |
| C16 | C18 | H6 | 109.4° | 109.5° |
| C16 | C18 | H7 | 109.5° | 109.5° |
| H2 | C17 | H3 | 109.5° | 109.4° |
| H2 | C17 | H4 | 109.4° | 109.5° |
| H3 | C17 | H4 | 109.4° | 109.5° |
| H5 | C18 | H6 | 109.5° | 109.4° |
| H5 | C18 | H7 | 109.4° | 109.5° |
| H6 | C18 | H7 | 109.5° | 109.5° |
| H8 | C19 | H9 | 109.5° | 109.5° |
| H8 | C19 | H10 | 109.5° | 109.4° |
| H9 | C19 | H10 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CL1 | C23 | C22 | C24 | 179.9° | 180.0° |
| CL1 | C23 | C24 | CL2 | 0.0° | 0.0° |
| CL1 | C23 | C22 | C21 | 179.9° | 179.9° |
| CL1 | C23 | C24 | C25 | 179.9° | 179.2° |
| CL1 | C23 | C22 | H11 | 0.1° | 0.0° |
| C22 | C23 | C24 | CL2 | 179.9° | 180.0° |
| C23 | C22 | C21 | H11 | 180.0° | 179.9° |
| C22 | C23 | C24 | C25 | 0.0° | 0.8° |
| C23 | C22 | C21 | N13 | 179.9° | 180.0° |
| C23 | C22 | C21 | C20 | 0.0° | 0.6° |
| C23 | C24 | CL2 | C25 | 179.9° | 179.2° |
| C24 | C23 | C22 | C21 | 0.0° | 0.1° |
| C23 | C24 | C25 | C20 | 0.0° | 1.1° |
| C24 | C23 | C22 | H11 | 180.0° | 180.0° |
| C23 | C24 | C25 | H12 | 179.9° | 180.0° |
| CL2 | C24 | C25 | C20 | 180.0° | 179.7° |
| CL2 | C24 | C25 | H12 | 0.0° | 0.8° |
| C22 | C21 | N13 | C20 | 179.9° | 179.5° |
| C22 | C21 | C20 | C25 | 0.0° | 0.2° |
| C22 | C21 | N13 | C12 | 179.7° | 180.0° |
| C22 | C21 | C20 | N28 | 179.9° | 179.7° |
| C24 | C25 | C20 | C21 | 0.1° | 0.6° |
| C24 | C25 | C20 | H12 | 180.0° | 178.9° |
| C24 | C25 | C20 | N28 | 179.9° | 178.9° |
| N13 | C21 | C20 | C25 | 179.9° | 179.7° |
| N13 | C21 | C20 | N28 | 0.1° | 0.8° |
| C21 | N13 | C12 | C14 | 0.4° | 0.1° |
| C21 | N13 | C12 | H1 | 179.6° | 179.7° |
| N13 | C21 | C22 | H11 | 0.1° | 0.1° |
| C21 | C20 | C25 | N28 | 179.8° | 179.5° |
| C20 | C21 | N13 | C12 | 0.4° | 0.6° |
| C21 | C20 | N28 | C14 | 0.5° | 0.5° |
| C20 | C21 | C22 | H11 | 180.0° | 179.5° |
| C21 | C20 | C25 | H12 | 179.9° | 179.5° |
| C25 | C20 | N28 | C14 | 179.7° | 180.0° |
| N13 | C12 | C14 | H1 | 180.0° | 179.8° |
| N13 | C12 | C14 | N28 | 0.0° | 0.2° |
| N13 | C12 | C14 | N15 | 179.6° | 179.7° |
| C20 | N28 | C14 | C12 | 0.4° | 0.0° |
| C20 | N28 | C14 | N15 | 179.9° | 179.9° |
| N28 | C20 | C25 | H12 | 0.1° | 0.0° |
| C12 | C14 | N28 | N15 | 179.7° | 179.9° |
| C12 | C14 | N15 | C16 | 157.1° | 177.4° |
| C12 | C14 | N15 | H13 | 80.9° | 2.6° |
| N28 | C14 | N15 | C16 | 23.3° | 2.5° |
| N28 | C14 | C12 | H1 | 180.0° | 180.0° |
| N28 | C14 | N15 | H13 | 98.8° | 177.4° |
| C14 | N15 | C16 | H13 | 122.0° | 180.0° |
| C14 | N15 | C16 | C19 | 47.2° | 177.9° |
| C14 | N15 | C16 | C17 | 75.2° | 62.2° |
| C14 | N15 | C16 | C18 | 166.1° | 57.8° |
| N15 | C14 | C12 | H1 | 0.4° | 0.1° |
| N15 | C16 | C19 | C17 | 122.3° | 120.0° |
| N15 | C16 | C19 | C18 | 118.8° | 120.0° |
| N15 | C16 | C17 | C18 | 118.2° | 120.0° |
| N15 | C16 | C17 | H2 | 180.0° | 57.4° |
| N15 | C16 | C17 | H3 | 60.0° | 62.5° |
| N15 | C16 | C17 | H4 | 60.0° | 177.4° |
| N15 | C16 | C18 | H5 | 180.0° | 173.4° |
| N15 | C16 | C18 | H6 | 60.0° | 53.5° |
| N15 | C16 | C18 | H7 | 60.0° | 66.5° |
| N15 | C16 | C19 | H8 | 180.0° | 60.1° |
| N15 | C16 | C19 | H9 | 60.0° | 60.0° |
| N15 | C16 | C19 | H10 | 60.0° | 180.0° |
| C19 | C16 | C17 | C18 | 118.5° | 120.0° |
| C19 | C16 | C17 | H2 | 56.7° | 177.4° |
| C19 | C16 | C17 | H3 | 63.4° | 57.5° |
| C19 | C16 | C17 | H4 | 176.7° | 62.6° |
| C19 | C16 | C18 | H5 | 59.0° | 53.4° |
| C19 | C16 | C18 | H6 | 178.9° | 66.5° |
| C19 | C16 | C18 | H7 | 61.0° | 173.5° |
| C16 | C19 | H8 | H9 | 120.0° | 120.0° |
| C16 | C19 | H8 | H10 | 120.0° | 119.9° |
| C16 | C19 | H9 | H10 | 120.0° | 120.0° |
| C19 | C16 | N15 | H13 | 169.2° | 2.2° |
| C16 | C17 | H2 | H3 | 120.0° | 119.9° |
| C16 | C17 | H2 | H4 | 120.0° | 120.0° |
| C16 | C17 | H3 | H4 | 120.0° | 120.0° |
| C17 | C16 | C18 | H5 | 60.7° | 66.6° |
| C17 | C16 | C18 | H6 | 59.3° | 173.5° |
| C17 | C16 | C18 | H7 | 179.3° | 53.5° |
| C17 | C16 | C19 | H8 | 57.7° | 59.9° |
| C17 | C16 | C19 | H9 | 177.7° | 180.0° |
| C17 | C16 | C19 | H10 | 62.4° | 60.0° |
| C17 | C16 | N15 | H13 | 46.8° | 117.8° |
| C18 | C16 | C17 | H2 | 61.8° | 62.6° |
| C18 | C16 | C17 | H3 | 178.2° | 177.5° |
| C18 | C16 | C17 | H4 | 58.2° | 57.4° |
| C16 | C18 | H5 | H6 | 120.0° | 120.0° |
| C16 | C18 | H5 | H7 | 120.0° | 120.0° |
| C16 | C18 | H6 | H7 | 120.0° | 120.0° |
| C18 | C16 | C19 | H8 | 61.2° | 179.9° |
| C18 | C16 | C19 | H9 | 58.8° | 60.0° |
| C18 | C16 | C19 | H10 | 178.8° | 60.0° |
| C18 | C16 | N15 | H13 | 71.9° | 122.2° |
| H2 | C17 | H3 | H4 | 120.0° | 120.1° |
| H5 | C18 | H6 | H7 | 120.0° | 120.0° |
| H8 | C19 | H9 | H10 | 120.0° | 120.0° |
