N6P
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O6 | P1 | doub | 1.48Å | 1.51Å | |
| P1 | O7 | sing | 1.61Å | 1.50Å | |
| P1 | O5 | sing | 1.61Å | 1.48Å | |
| P1 | O4 | sing | 1.61Å | 1.59Å | |
| O4 | C20 | sing | 1.43Å | 1.44Å | |
| O1 | C19 | sing | 1.44Å | 1.33Å | |
| O1 | C16 | sing | 1.44Å | 1.60Å | |
| C20 | C19 | sing | 1.53Å | 1.52Å | |
| C15 | N3 | doub | 1.30Å | 1.36Å | Aromatic |
| C15 | N4 | sing | 1.36Å | 1.33Å | Aromatic |
| N3 | C14 | sing | 1.35Å | 1.37Å | Aromatic |
| C8 | C9 | doub | 1.36Å | 1.38Å | Aromatic |
| C8 | C7 | sing | 1.41Å | 1.39Å | Aromatic |
| C19 | C18 | sing | 1.54Å | 1.55Å | |
| C9 | C10 | sing | 1.41Å | 1.40Å | Aromatic |
| N4 | C16 | sing | 1.47Å | 1.38Å | |
| N4 | C13 | sing | 1.37Å | 1.37Å | Aromatic |
| C6 | C7 | doub | 1.41Å | 1.39Å | Aromatic |
| C6 | C5 | sing | 1.36Å | 1.39Å | Aromatic |
| C16 | C17 | sing | 1.55Å | 1.36Å | |
| C7 | C2 | sing | 1.42Å | 1.39Å | Aromatic |
| C14 | C13 | doub | 1.41Å | 1.42Å | Aromatic |
| C14 | C11 | sing | 1.41Å | 1.43Å | Aromatic |
| C10 | C11 | sing | 1.48Å | 1.52Å | |
| C10 | C1 | doub | 1.38Å | 1.38Å | Aromatic |
| C13 | N2 | sing | 1.33Å | 1.37Å | Aromatic |
| C5 | C4 | doub | 1.39Å | 1.39Å | Aromatic |
| C18 | C17 | sing | 1.55Å | 1.56Å | |
| C18 | O3 | sing | 1.43Å | 1.35Å | |
| C11 | N1 | doub | 1.33Å | 1.35Å | Aromatic |
| C17 | O2 | sing | 1.43Å | 1.48Å | |
| C2 | C1 | sing | 1.40Å | 1.39Å | Aromatic |
| C2 | C3 | doub | 1.41Å | 1.40Å | Aromatic |
| N2 | C12 | doub | 1.32Å | 1.35Å | Aromatic |
| C4 | C3 | sing | 1.36Å | 1.39Å | Aromatic |
| N1 | C12 | sing | 1.32Å | 1.32Å | Aromatic |
| C1 | H1 | sing | 1.08Å | 1.08Å | |
| C3 | H2 | sing | 1.08Å | 1.08Å | |
| C4 | H3 | sing | 1.08Å | 1.08Å | |
| C5 | H4 | sing | 1.08Å | 1.08Å | |
| C6 | H5 | sing | 1.08Å | 1.08Å | |
| C8 | H6 | sing | 1.08Å | 1.08Å | |
| C9 | H7 | sing | 1.08Å | 1.08Å | |
| C12 | H8 | sing | 1.08Å | 1.08Å | |
| C15 | H9 | sing | 1.08Å | 1.08Å | |
| C16 | H10 | sing | 1.09Å | 1.10Å | |
| C17 | H11 | sing | 1.09Å | 1.10Å | |
| O2 | H12 | sing | 0.97Å | 0.95Å | |
| C18 | H13 | sing | 1.09Å | 1.10Å | |
| O3 | H14 | sing | 0.97Å | 0.95Å | |
| C19 | H15 | sing | 1.09Å | 1.10Å | |
| C20 | H16 | sing | 1.09Å | 1.10Å | |
| C20 | H17 | sing | 1.09Å | 1.10Å | |
| O5 | H18 | sing | 0.97Å | 0.95Å | |
| O7 | H19 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O6 | P1 | O7 | 110.2° | 109.5° |
| O6 | P1 | O5 | 110.1° | 109.5° |
| O6 | P1 | O4 | 105.9° | 109.5° |
| O7 | P1 | O5 | 110.7° | 109.4° |
| O7 | P1 | O4 | 108.1° | 109.5° |
| P1 | O7 | H19 | 109.5° | 114.0° |
| O5 | P1 | O4 | 111.6° | 109.5° |
| P1 | O5 | H18 | 109.5° | 114.0° |
| P1 | O4 | C20 | 119.6° | 122.9° |
| O4 | C20 | C19 | 106.9° | 109.4° |
| O4 | C20 | H16 | 110.1° | 109.5° |
| O4 | C20 | H17 | 110.1° | 109.5° |
| C19 | O1 | C16 | 112.1° | 107.0° |
| O1 | C19 | C20 | 113.0° | 109.9° |
| O1 | C19 | C18 | 106.9° | 107.3° |
| O1 | C19 | H15 | 111.8° | 109.9° |
| O1 | C16 | N4 | 105.0° | 110.6° |
| O1 | C16 | C17 | 104.6° | 103.5° |
| O1 | C16 | H10 | 110.5° | 110.8° |
| C20 | C19 | C18 | 107.4° | 109.9° |
| C20 | C19 | H15 | 108.9° | 109.9° |
| C19 | C20 | H16 | 110.1° | 109.4° |
| C19 | C20 | H17 | 110.1° | 109.4° |
| N3 | C15 | N4 | 110.1° | 110.0° |
| C15 | N3 | C14 | 107.5° | 109.5° |
| N3 | C15 | H9 | 124.9° | 125.0° |
| C15 | N4 | C16 | 126.9° | 126.3° |
| C15 | N4 | C13 | 108.7° | 107.4° |
| N4 | C15 | H9 | 124.9° | 125.0° |
| N3 | C14 | C13 | 107.0° | 107.1° |
| N3 | C14 | C11 | 134.8° | 134.8° |
| C9 | C8 | C7 | 120.1° | 120.0° |
| C8 | C9 | C10 | 120.0° | 120.8° |
| C9 | C8 | H6 | 119.9° | 120.0° |
| C8 | C9 | H7 | 120.0° | 119.5° |
| C8 | C7 | C6 | 119.7° | 121.0° |
| C8 | C7 | C2 | 119.8° | 119.7° |
| C7 | C8 | H6 | 120.0° | 120.0° |
| C19 | C18 | C17 | 104.7° | 104.2° |
| C19 | C18 | O3 | 106.8° | 110.5° |
| C19 | C18 | H13 | 109.1° | 110.6° |
| C18 | C19 | H15 | 108.6° | 109.9° |
| C9 | C10 | C11 | 122.2° | 119.7° |
| C9 | C10 | C1 | 119.7° | 120.5° |
| C10 | C9 | H7 | 120.0° | 119.6° |
| C16 | N4 | C13 | 124.2° | 126.3° |
| N4 | C16 | C17 | 107.5° | 110.6° |
| N4 | C16 | H10 | 113.9° | 110.6° |
| N4 | C13 | C14 | 106.6° | 106.0° |
| N4 | C13 | N2 | 134.1° | 135.0° |
| C7 | C6 | C5 | 119.8° | 119.6° |
| C6 | C7 | C2 | 120.5° | 119.3° |
| C7 | C6 | H5 | 120.1° | 120.2° |
| C6 | C5 | C4 | 119.4° | 121.1° |
| C6 | C5 | H4 | 120.3° | 119.4° |
| C5 | C6 | H5 | 120.1° | 120.2° |
| C16 | C17 | C18 | 110.3° | 102.1° |
| C16 | C17 | O2 | 113.8° | 110.9° |
| C17 | C16 | H10 | 114.4° | 110.7° |
| C16 | C17 | H11 | 110.0° | 110.9° |
| C7 | C2 | C1 | 120.3° | 119.5° |
| C7 | C2 | C3 | 119.9° | 119.4° |
| C13 | C14 | C11 | 118.2° | 118.1° |
| C14 | C13 | N2 | 119.3° | 119.0° |
| C14 | C11 | C10 | 122.8° | 120.8° |
| C14 | C11 | N1 | 118.6° | 118.4° |
| C11 | C10 | C1 | 117.7° | 119.8° |
| C10 | C11 | N1 | 118.5° | 120.8° |
| C10 | C1 | C2 | 120.1° | 119.5° |
| C10 | C1 | H1 | 119.9° | 120.3° |
| C13 | N2 | C12 | 119.0° | 120.8° |
| C5 | C4 | C3 | 120.9° | 120.9° |
| C5 | C4 | H3 | 119.6° | 119.5° |
| C4 | C5 | H4 | 120.3° | 119.5° |
| C17 | C18 | O3 | 114.9° | 110.5° |
| C18 | C17 | O2 | 107.0° | 110.9° |
| C18 | C17 | H11 | 107.3° | 110.9° |
| C17 | C18 | H13 | 108.9° | 110.5° |
| O3 | C18 | H13 | 112.0° | 110.4° |
| C18 | O3 | H14 | 109.5° | 114.0° |
| C11 | N1 | C12 | 121.1° | 121.2° |
| O2 | C17 | H11 | 108.2° | 110.8° |
| C17 | O2 | H12 | 109.5° | 114.0° |
| C1 | C2 | C3 | 119.8° | 121.1° |
| C2 | C1 | H1 | 119.9° | 120.2° |
| C2 | C3 | C4 | 119.5° | 119.6° |
| C2 | C3 | H2 | 120.3° | 120.2° |
| N2 | C12 | N1 | 123.8° | 122.5° |
| N2 | C12 | H8 | 118.1° | 118.8° |
| C4 | C3 | H2 | 120.3° | 120.2° |
| C3 | C4 | H3 | 119.5° | 119.5° |
| N1 | C12 | H8 | 118.1° | 118.7° |
| H16 | C20 | H17 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O6 | P1 | O7 | O5 | 122.1° | 120.0° |
| O6 | P1 | O7 | O4 | 115.3° | 120.0° |
| O6 | P1 | O5 | O4 | 117.3° | 120.0° |
| O6 | P1 | O4 | C20 | 179.1° | 55.0° |
| O6 | P1 | O5 | H18 | 0.0° | 180.0° |
| O6 | P1 | O7 | H19 | 0.0° | 60.0° |
| O7 | P1 | O5 | O4 | 120.5° | 120.0° |
| O7 | P1 | O4 | C20 | 60.9° | 175.0° |
| O7 | P1 | O5 | H18 | 122.2° | 60.0° |
| O5 | P1 | O4 | C20 | 61.1° | 65.1° |
| O5 | P1 | O7 | H19 | 122.1° | 60.0° |
| P1 | O4 | C20 | C19 | 167.5° | 180.0° |
| P1 | O4 | C20 | H16 | 47.9° | 60.1° |
| P1 | O4 | C20 | H17 | 72.9° | 60.0° |
| O4 | P1 | O5 | H18 | 117.3° | 59.9° |
| O4 | P1 | O7 | H19 | 115.3° | 180.0° |
| O4 | C20 | C19 | O1 | 55.8° | 66.5° |
| O4 | C20 | C19 | H16 | 119.6° | 120.0° |
| O4 | C20 | C19 | H17 | 119.6° | 120.0° |
| O4 | C20 | C19 | C18 | 173.4° | 175.7° |
| O4 | C20 | C19 | H15 | 69.1° | 54.7° |
| O4 | C20 | H16 | H17 | 121.2° | 120.1° |
| O1 | C19 | C20 | C18 | 117.6° | 117.8° |
| O1 | C19 | C20 | H15 | 124.9° | 121.1° |
| O1 | C19 | C18 | H15 | 120.8° | 119.5° |
| C19 | O1 | C16 | N4 | 100.7° | 158.6° |
| C19 | O1 | C16 | C17 | 12.4° | 40.1° |
| O1 | C19 | C18 | C17 | 3.0° | 2.0° |
| O1 | C19 | C18 | O3 | 119.3° | 120.7° |
| C19 | O1 | C16 | H10 | 136.0° | 78.5° |
| O1 | C19 | C18 | H13 | 119.5° | 116.7° |
| O1 | C19 | C20 | H16 | 63.8° | 173.6° |
| O1 | C19 | C20 | H17 | 175.4° | 53.5° |
| C16 | O1 | C19 | C20 | 108.9° | 145.9° |
| O1 | C16 | N4 | C15 | 1.8° | 19.0° |
| C16 | O1 | C19 | C18 | 9.0° | 26.5° |
| O1 | C16 | N4 | C17 | 111.0° | 114.0° |
| O1 | C16 | N4 | H10 | 121.1° | 123.0° |
| O1 | C16 | N4 | C13 | 174.5° | 160.6° |
| O1 | C16 | C17 | H10 | 121.1° | 118.7° |
| O1 | C16 | C17 | C18 | 9.6° | 37.1° |
| O1 | C16 | C17 | O2 | 110.6° | 155.2° |
| O1 | C16 | C17 | H11 | 127.8° | 81.2° |
| C16 | O1 | C19 | H15 | 127.8° | 92.9° |
| C20 | C19 | C18 | H15 | 117.7° | 121.1° |
| C20 | C19 | C18 | C17 | 118.5° | 121.5° |
| C20 | C19 | C18 | O3 | 119.2° | 119.9° |
| C20 | C19 | C18 | H13 | 2.0° | 2.7° |
| C19 | C20 | H16 | H17 | 121.1° | 120.0° |
| N3 | C15 | N4 | H9 | 180.0° | 179.8° |
| N3 | C15 | N4 | C16 | 177.5° | 180.0° |
| N3 | C15 | N4 | C13 | 0.8° | 0.4° |
| C15 | N3 | C14 | C13 | 0.3° | 0.1° |
| C15 | N3 | C14 | C11 | 179.1° | 179.4° |
| N4 | C15 | N3 | C14 | 0.7° | 0.3° |
| C15 | N4 | C16 | C13 | 176.3° | 179.6° |
| C15 | N4 | C16 | C17 | 112.8° | 95.0° |
| C15 | N4 | C13 | C14 | 0.6° | 0.3° |
| C15 | N4 | C13 | N2 | 179.0° | 179.9° |
| C15 | N4 | C16 | H10 | 119.3° | 142.1° |
| N3 | C14 | C13 | N4 | 0.2° | 0.1° |
| N3 | C14 | C13 | C11 | 179.5° | 179.6° |
| N3 | C14 | C11 | C10 | 2.4° | 0.4° |
| N3 | C14 | C13 | N2 | 179.4° | 179.9° |
| N3 | C14 | C11 | N1 | 179.4° | 179.9° |
| C14 | N3 | C15 | H9 | 179.3° | 180.0° |
| C9 | C8 | C7 | H6 | 180.0° | 179.7° |
| C8 | C9 | C10 | H7 | 180.0° | 179.8° |
| C9 | C8 | C7 | C6 | 179.8° | 180.0° |
| C9 | C8 | C7 | C2 | 0.0° | 0.1° |
| C8 | C9 | C10 | C11 | 177.0° | 180.0° |
| C8 | C9 | C10 | C1 | 3.9° | 0.6° |
| C7 | C8 | C9 | C10 | 2.0° | 0.2° |
| C8 | C7 | C6 | C2 | 179.9° | 179.9° |
| C8 | C7 | C6 | C5 | 179.9° | 180.0° |
| C8 | C7 | C2 | C1 | 0.0° | 0.1° |
| C8 | C7 | C2 | C3 | 179.7° | 180.0° |
| C8 | C7 | C6 | H5 | 0.1° | 0.0° |
| C7 | C8 | C9 | H7 | 178.0° | 179.9° |
| C19 | C18 | C17 | C16 | 5.0° | 20.9° |
| C19 | C18 | C17 | O3 | 116.9° | 118.7° |
| C19 | C18 | C17 | H13 | 116.6° | 118.8° |
| C19 | C18 | O3 | H13 | 119.4° | 122.7° |
| C19 | C18 | C17 | O2 | 119.3° | 139.1° |
| C19 | C18 | C17 | H11 | 124.8° | 97.4° |
| C19 | C18 | O3 | H14 | 180.0° | 176.2° |
| C18 | C19 | C20 | H16 | 53.8° | 55.7° |
| C18 | C19 | C20 | H17 | 67.0° | 64.3° |
| C9 | C10 | C11 | C14 | 4.2° | 35.3° |
| C9 | C10 | C11 | C1 | 173.2° | 179.4° |
| C9 | C10 | C11 | N1 | 178.8° | 145.0° |
| C9 | C10 | C1 | C2 | 3.9° | 0.6° |
| C9 | C10 | C1 | H1 | 176.2° | 179.7° |
| C10 | C9 | C8 | H6 | 178.0° | 180.0° |
| N4 | C16 | C17 | H10 | 127.6° | 122.9° |
| C16 | N4 | C13 | C14 | 177.5° | 180.0° |
| C16 | N4 | C13 | N2 | 2.1° | 0.3° |
| N4 | C16 | C17 | C18 | 101.7° | 155.5° |
| N4 | C16 | C17 | O2 | 138.1° | 86.3° |
| C16 | N4 | C15 | H9 | 2.4° | 0.2° |
| N4 | C16 | C17 | H11 | 16.5° | 37.2° |
| C13 | N4 | C16 | C17 | 63.5° | 85.4° |
| N4 | C13 | C14 | N2 | 179.6° | 179.8° |
| N4 | C13 | C14 | C11 | 179.7° | 179.7° |
| N4 | C13 | N2 | C12 | 179.6° | 180.0° |
| C13 | N4 | C15 | H9 | 179.2° | 179.9° |
| C13 | N4 | C16 | H10 | 64.4° | 37.5° |
| C7 | C6 | C5 | H5 | 180.0° | 180.0° |
| C7 | C6 | C5 | C4 | 0.5° | 0.0° |
| C6 | C7 | C2 | C1 | 179.9° | 180.0° |
| C6 | C7 | C2 | C3 | 0.1° | 0.1° |
| C7 | C6 | C5 | H4 | 179.4° | 180.0° |
| C6 | C7 | C8 | H6 | 0.2° | 0.3° |
| C5 | C6 | C7 | C2 | 0.1° | 0.0° |
| C6 | C5 | C4 | H4 | 180.0° | 180.0° |
| C6 | C5 | C4 | C3 | 0.8° | 0.1° |
| C6 | C5 | C4 | H3 | 179.2° | 180.0° |
| C16 | C17 | C18 | O2 | 124.3° | 118.2° |
| C16 | C17 | C18 | H11 | 119.8° | 118.3° |
| C16 | C17 | C18 | O3 | 121.9° | 97.8° |
| C16 | C17 | O2 | H11 | 122.6° | 123.6° |
| C16 | C17 | O2 | H12 | 180.0° | 180.0° |
| C16 | C17 | C18 | H13 | 111.5° | 139.7° |
| C7 | C2 | C1 | C10 | 1.9° | 0.3° |
| C7 | C2 | C1 | C3 | 179.7° | 180.0° |
| C7 | C2 | C3 | C4 | 0.1° | 0.0° |
| C7 | C2 | C1 | H1 | 178.1° | 180.0° |
| C7 | C2 | C3 | H2 | 179.9° | 180.0° |
| C2 | C7 | C6 | H5 | 179.9° | 180.0° |
| C2 | C7 | C8 | H6 | 180.0° | 179.6° |
| C13 | C14 | C11 | C10 | 176.9° | 179.8° |
| C13 | C14 | C11 | N1 | 0.0° | 0.5° |
| C14 | C13 | N2 | C12 | 0.9° | 0.3° |
| C14 | C11 | C10 | N1 | 177.0° | 179.8° |
| C14 | C11 | C10 | C1 | 169.0° | 144.1° |
| C11 | C14 | C13 | N2 | 0.1° | 0.5° |
| C14 | C11 | N1 | C12 | 0.7° | 0.2° |
| C11 | C10 | C1 | C2 | 177.3° | 180.0° |
| C10 | C11 | N1 | C12 | 177.8° | 180.0° |
| C11 | C10 | C1 | H1 | 2.8° | 0.3° |
| C11 | C10 | C9 | H7 | 3.0° | 0.2° |
| C1 | C10 | C11 | N1 | 8.0° | 35.6° |
| C10 | C1 | C2 | H1 | 180.0° | 179.7° |
| C10 | C1 | C2 | C3 | 178.4° | 179.7° |
| C1 | C10 | C9 | H7 | 176.1° | 179.6° |
| C13 | N2 | C12 | N1 | 1.7° | 0.1° |
| C13 | N2 | C12 | H8 | 178.3° | 180.0° |
| C5 | C4 | C3 | C2 | 0.6° | 0.1° |
| C5 | C4 | C3 | H3 | 180.0° | 179.9° |
| C5 | C4 | C3 | H2 | 179.4° | 179.9° |
| C4 | C5 | C6 | H5 | 179.4° | 180.0° |
| C17 | C18 | O3 | H13 | 125.0° | 122.6° |
| C18 | C17 | O2 | H11 | 115.3° | 123.7° |
| C18 | C17 | C16 | H10 | 130.7° | 81.6° |
| C18 | C17 | O2 | H12 | 57.9° | 67.3° |
| C17 | C18 | O3 | H14 | 64.3° | 61.4° |
| C17 | C18 | C19 | H15 | 123.9° | 117.4° |
| O3 | C18 | C17 | O2 | 2.4° | 20.4° |
| O3 | C18 | C17 | H11 | 118.3° | 144.0° |
| O3 | C18 | C19 | H15 | 1.5° | 1.2° |
| C11 | N1 | C12 | N2 | 1.6° | 0.0° |
| C11 | N1 | C12 | H8 | 178.4° | 180.0° |
| O2 | C17 | C16 | H10 | 10.4° | 36.6° |
| O2 | C17 | C18 | H13 | 124.2° | 102.1° |
| C1 | C2 | C3 | C4 | 179.6° | 180.0° |
| C1 | C2 | C3 | H2 | 0.4° | 0.1° |
| C2 | C3 | C4 | H2 | 180.0° | 180.0° |
| C3 | C2 | C1 | H1 | 1.6° | 0.0° |
| C2 | C3 | C4 | H3 | 179.4° | 179.9° |
| N2 | C12 | N1 | H8 | 180.0° | 180.0° |
| C3 | C4 | C5 | H4 | 179.2° | 179.9° |
| H2 | C3 | C4 | H3 | 0.6° | 0.0° |
| H3 | C4 | C5 | H4 | 0.8° | 0.1° |
| H4 | C5 | C6 | H5 | 0.6° | 0.0° |
| H6 | C8 | C9 | H7 | 2.0° | 0.2° |
| H10 | C16 | C17 | H11 | 111.2° | 160.1° |
| H11 | C17 | O2 | H12 | 57.4° | 56.4° |
| H11 | C17 | C18 | H13 | 8.3° | 21.5° |
| H13 | C18 | O3 | H14 | 60.6° | 61.1° |
| H13 | C18 | C19 | H15 | 119.7° | 123.8° |
| H15 | C19 | C20 | H16 | 171.3° | 65.3° |
| H15 | C19 | C20 | H17 | 50.5° | 174.7° |
