H7N
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C10 | C9 | sing | 1.53Å | 1.55Å | |
| C9 | C8 | sing | 1.53Å | 1.55Å | |
| C8 | C7 | sing | 1.53Å | 1.54Å | |
| C7 | C6 | sing | 1.53Å | 1.54Å | |
| C6 | C5 | sing | 1.53Å | 1.52Å | |
| C5 | P1 | sing | 1.82Å | 1.82Å | |
| O3 | P1 | doub | 1.48Å | 1.47Å | |
| P1 | O4 | sing | 1.61Å | 1.48Å | |
| O4 | C11 | sing | 1.43Å | 1.42Å | |
| C11 | C12 | sing | 1.53Å | 1.54Å | |
| C12 | C13 | sing | 1.53Å | 1.54Å | |
| C13 | C1 | sing | 1.53Å | 1.55Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C1 | H3 | sing | 1.09Å | 1.10Å | |
| C5 | H4 | sing | 1.09Å | 1.10Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| C6 | H7 | sing | 1.09Å | 1.10Å | |
| C6 | H8 | sing | 1.09Å | 1.10Å | |
| C7 | H9 | sing | 1.09Å | 1.10Å | |
| C7 | H10 | sing | 1.09Å | 1.10Å | |
| C8 | H11 | sing | 1.09Å | 1.10Å | |
| C8 | H12 | sing | 1.09Å | 1.10Å | |
| C9 | H13 | sing | 1.09Å | 1.10Å | |
| C9 | H14 | sing | 1.09Å | 1.10Å | |
| C10 | H15 | sing | 1.09Å | 1.10Å | |
| C10 | H16 | sing | 1.09Å | 1.10Å | |
| C10 | H17 | sing | 1.09Å | 1.10Å | |
| C11 | H18 | sing | 1.09Å | 1.10Å | |
| C11 | H19 | sing | 1.09Å | 1.10Å | |
| C12 | H20 | sing | 1.09Å | 1.10Å | |
| C12 | H21 | sing | 1.09Å | 1.10Å | |
| C13 | H22 | sing | 1.09Å | 1.10Å | |
| C13 | H23 | sing | 1.09Å | 1.10Å | |
| P1 | O1 | sing | 1.61Å | 1.39Å | |
| O1 | H6 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C10 | C9 | C8 | 112.3° | 109.5° |
| C10 | C9 | H13 | 108.7° | 109.5° |
| C10 | C9 | H14 | 108.8° | 109.5° |
| C9 | C10 | H15 | 109.5° | 109.5° |
| C9 | C10 | H16 | 109.5° | 109.5° |
| C9 | C10 | H17 | 109.4° | 109.5° |
| C9 | C8 | C7 | 107.9° | 109.5° |
| C9 | C8 | H11 | 109.9° | 109.5° |
| C9 | C8 | H12 | 109.9° | 109.4° |
| C8 | C9 | H13 | 108.8° | 109.5° |
| C8 | C9 | H14 | 108.7° | 109.4° |
| C8 | C7 | C6 | 109.6° | 109.5° |
| C8 | C7 | H9 | 109.5° | 109.5° |
| C8 | C7 | H10 | 109.4° | 109.4° |
| C7 | C8 | H11 | 109.9° | 109.5° |
| C7 | C8 | H12 | 109.9° | 109.5° |
| C7 | C6 | C5 | 110.6° | 109.4° |
| C7 | C6 | H7 | 109.2° | 109.4° |
| C7 | C6 | H8 | 109.2° | 109.5° |
| C6 | C7 | H9 | 109.4° | 109.5° |
| C6 | C7 | H10 | 109.4° | 109.5° |
| C6 | C5 | P1 | 116.6° | 109.4° |
| C6 | C5 | H4 | 107.7° | 109.6° |
| C6 | C5 | H5 | 107.7° | 109.5° |
| C5 | C6 | H7 | 109.2° | 109.5° |
| C5 | C6 | H8 | 109.2° | 109.5° |
| C5 | P1 | O3 | 102.5° | 109.5° |
| C5 | P1 | O4 | 101.6° | 109.5° |
| P1 | C5 | H4 | 107.6° | 109.4° |
| P1 | C5 | H5 | 107.6° | 109.4° |
| C5 | P1 | O1 | 101.1° | 109.5° |
| O3 | P1 | O4 | 118.5° | 109.5° |
| O3 | P1 | O1 | 106.1° | 109.5° |
| P1 | O4 | C11 | 115.1° | 123.0° |
| O4 | P1 | O1 | 123.1° | 109.4° |
| O4 | C11 | C12 | 115.5° | 109.4° |
| O4 | C11 | H18 | 108.0° | 109.5° |
| O4 | C11 | H19 | 107.9° | 109.5° |
| C11 | C12 | C13 | 115.4° | 109.5° |
| C12 | C11 | H18 | 107.9° | 109.4° |
| C12 | C11 | H19 | 108.0° | 109.5° |
| C11 | C12 | H20 | 108.0° | 109.5° |
| C11 | C12 | H21 | 108.0° | 109.5° |
| C12 | C13 | C1 | 114.6° | 109.5° |
| C13 | C12 | H20 | 108.0° | 109.4° |
| C13 | C12 | H21 | 108.0° | 109.5° |
| C12 | C13 | H22 | 108.2° | 109.5° |
| C12 | C13 | H23 | 108.2° | 109.5° |
| C13 | C1 | H1 | 109.5° | 109.5° |
| C13 | C1 | H2 | 109.5° | 109.4° |
| C13 | C1 | H3 | 109.5° | 109.4° |
| C1 | C13 | H22 | 108.2° | 109.5° |
| C1 | C13 | H23 | 108.2° | 109.4° |
| H1 | C1 | H2 | 109.5° | 109.5° |
| H1 | C1 | H3 | 109.5° | 109.4° |
| H2 | C1 | H3 | 109.5° | 109.5° |
| H4 | C5 | H5 | 109.5° | 109.5° |
| H7 | C6 | H8 | 109.5° | 109.5° |
| H9 | C7 | H10 | 109.4° | 109.4° |
| H11 | C8 | H12 | 109.5° | 109.4° |
| H13 | C9 | H14 | 109.5° | 109.4° |
| H15 | C10 | H16 | 109.5° | 109.5° |
| H15 | C10 | H17 | 109.5° | 109.5° |
| H16 | C10 | H17 | 109.4° | 109.4° |
| H18 | C11 | H19 | 109.5° | 109.5° |
| H20 | C12 | H21 | 109.5° | 109.5° |
| H22 | C13 | H23 | 109.5° | 109.4° |
| P1 | O1 | H6 | 109.5° | 114.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C10 | C9 | C8 | H13 | 120.4° | 120.0° |
| C10 | C9 | C8 | H14 | 120.4° | 120.0° |
| C10 | C9 | C8 | C7 | 168.8° | 180.0° |
| C10 | C9 | C8 | H11 | 49.1° | 59.9° |
| C10 | C9 | C8 | H12 | 71.4° | 60.0° |
| C10 | C9 | H13 | H14 | 118.7° | 120.0° |
| C9 | C10 | H15 | H16 | 120.0° | 120.0° |
| C9 | C10 | H15 | H17 | 120.0° | 120.0° |
| C9 | C10 | H16 | H17 | 119.9° | 120.0° |
| C9 | C8 | C7 | H11 | 119.7° | 120.1° |
| C9 | C8 | C7 | H12 | 119.8° | 120.0° |
| C9 | C8 | C7 | C6 | 164.6° | 180.0° |
| C9 | C8 | C7 | H9 | 75.3° | 60.0° |
| C9 | C8 | C7 | H10 | 44.6° | 60.0° |
| C9 | C8 | H11 | H12 | 120.7° | 119.9° |
| C8 | C9 | H13 | H14 | 118.7° | 120.0° |
| C8 | C9 | C10 | H15 | 180.0° | 180.0° |
| C8 | C9 | C10 | H16 | 60.0° | 60.0° |
| C8 | C9 | C10 | H17 | 60.0° | 60.0° |
| C8 | C7 | C6 | H9 | 120.1° | 120.0° |
| C8 | C7 | C6 | H10 | 120.0° | 120.0° |
| C8 | C7 | C6 | C5 | 155.9° | 180.0° |
| C8 | C7 | C6 | H7 | 35.7° | 60.0° |
| C8 | C7 | C6 | H8 | 84.0° | 60.0° |
| C8 | C7 | H9 | H10 | 119.9° | 119.9° |
| C7 | C8 | H11 | H12 | 120.8° | 120.0° |
| C7 | C8 | C9 | H13 | 70.8° | 60.0° |
| C7 | C8 | C9 | H14 | 48.4° | 60.0° |
| C7 | C6 | C5 | H7 | 120.2° | 119.9° |
| C7 | C6 | C5 | H8 | 120.2° | 120.0° |
| C7 | C6 | C5 | P1 | 179.0° | 180.0° |
| C7 | C6 | C5 | H4 | 60.0° | 60.0° |
| C7 | C6 | C5 | H5 | 57.9° | 60.0° |
| C7 | C6 | H7 | H8 | 119.4° | 120.0° |
| C6 | C7 | H9 | H10 | 119.9° | 120.1° |
| C6 | C7 | C8 | H11 | 44.9° | 60.0° |
| C6 | C7 | C8 | H12 | 75.6° | 60.0° |
| C6 | C5 | P1 | H4 | 121.0° | 120.1° |
| C6 | C5 | P1 | H5 | 121.0° | 120.0° |
| C6 | C5 | P1 | O3 | 20.8° | 55.0° |
| C6 | C5 | P1 | O4 | 102.2° | 175.0° |
| C6 | C5 | H4 | H5 | 116.8° | 120.1° |
| C5 | C6 | H7 | H8 | 119.5° | 120.1° |
| C5 | C6 | C7 | H9 | 84.1° | 60.0° |
| C5 | C6 | C7 | H10 | 35.8° | 60.0° |
| C6 | C5 | P1 | O1 | 130.3° | 65.0° |
| C5 | P1 | O3 | O4 | 110.9° | 120.0° |
| C5 | P1 | O3 | O1 | 105.6° | 120.0° |
| C5 | P1 | O4 | O1 | 111.7° | 120.0° |
| C5 | P1 | O4 | C11 | 154.5° | 175.0° |
| P1 | C5 | H4 | H5 | 116.7° | 120.0° |
| P1 | C5 | C6 | H7 | 58.8° | 60.0° |
| P1 | C5 | C6 | H8 | 60.9° | 60.1° |
| C5 | P1 | O1 | H6 | 106.7° | 60.0° |
| O3 | P1 | O4 | O1 | 137.0° | 120.0° |
| O3 | P1 | O4 | C11 | 43.1° | 54.9° |
| O3 | P1 | C5 | H4 | 100.2° | 65.0° |
| O3 | P1 | C5 | H5 | 141.9° | 175.0° |
| O3 | P1 | O1 | H6 | 0.0° | 180.0° |
| P1 | O4 | C11 | C12 | 138.2° | 180.0° |
| O4 | P1 | C5 | H4 | 136.8° | 55.0° |
| O4 | P1 | C5 | H5 | 18.8° | 65.0° |
| P1 | O4 | C11 | H18 | 17.4° | 60.0° |
| P1 | O4 | C11 | H19 | 100.9° | 60.1° |
| O4 | P1 | O1 | H6 | 141.4° | 60.0° |
| O4 | C11 | C12 | H18 | 120.9° | 120.0° |
| O4 | C11 | C12 | H19 | 120.9° | 120.0° |
| O4 | C11 | C12 | C13 | 145.3° | 180.0° |
| O4 | C11 | H18 | H19 | 117.3° | 120.0° |
| O4 | C11 | C12 | H20 | 24.4° | 60.0° |
| O4 | C11 | C12 | H21 | 93.8° | 60.0° |
| C11 | O4 | P1 | O1 | 93.9° | 65.0° |
| C11 | C12 | C13 | H20 | 120.9° | 120.0° |
| C11 | C12 | C13 | H21 | 120.8° | 120.1° |
| C11 | C12 | C13 | C1 | 138.7° | 180.0° |
| C12 | C11 | H18 | H19 | 117.3° | 120.0° |
| C11 | C12 | H20 | H21 | 117.3° | 120.1° |
| C11 | C12 | C13 | H22 | 17.9° | 59.9° |
| C11 | C12 | C13 | H23 | 100.5° | 60.0° |
| C12 | C13 | C1 | H22 | 120.8° | 120.1° |
| C12 | C13 | C1 | H23 | 120.8° | 120.0° |
| C12 | C13 | C1 | H1 | 180.0° | 179.9° |
| C12 | C13 | C1 | H2 | 60.0° | 60.0° |
| C12 | C13 | C1 | H3 | 60.0° | 60.0° |
| C13 | C12 | C11 | H18 | 93.8° | 60.1° |
| C13 | C12 | C11 | H19 | 24.4° | 60.0° |
| C13 | C12 | H20 | H21 | 117.3° | 120.0° |
| C12 | C13 | H22 | H23 | 117.7° | 120.0° |
| C13 | C1 | H1 | H2 | 120.0° | 120.0° |
| C13 | C1 | H1 | H3 | 120.0° | 120.0° |
| C13 | C1 | H2 | H3 | 120.0° | 119.9° |
| C1 | C13 | C12 | H20 | 100.4° | 60.0° |
| C1 | C13 | C12 | H21 | 17.9° | 59.9° |
| C1 | C13 | H22 | H23 | 117.6° | 119.9° |
| H1 | C1 | H2 | H3 | 120.0° | 120.0° |
| H1 | C1 | C13 | H22 | 59.2° | 60.0° |
| H1 | C1 | C13 | H23 | 59.2° | 59.9° |
| H2 | C1 | C13 | H22 | 179.2° | 60.1° |
| H2 | C1 | C13 | H23 | 60.8° | 180.0° |
| H3 | C1 | C13 | H22 | 60.8° | 179.9° |
| H3 | C1 | C13 | H23 | 179.3° | 60.0° |
| H4 | C5 | C6 | H7 | 179.8° | 180.0° |
| H4 | C5 | C6 | H8 | 60.1° | 59.9° |
| H4 | C5 | P1 | O1 | 9.3° | 174.9° |
| H5 | C5 | C6 | H7 | 62.3° | 59.9° |
| H5 | C5 | C6 | H8 | 178.1° | 180.0° |
| H5 | C5 | P1 | O1 | 108.6° | 54.9° |
| H7 | C6 | C7 | H9 | 155.7° | 180.0° |
| H7 | C6 | C7 | H10 | 84.4° | 60.0° |
| H8 | C6 | C7 | H9 | 36.1° | 60.0° |
| H8 | C6 | C7 | H10 | 156.0° | 180.0° |
| H9 | C7 | C8 | H11 | 164.9° | 180.0° |
| H9 | C7 | C8 | H12 | 44.4° | 60.0° |
| H10 | C7 | C8 | H11 | 75.2° | 60.1° |
| H10 | C7 | C8 | H12 | 164.3° | 180.0° |
| H11 | C8 | C9 | H13 | 169.5° | 179.9° |
| H11 | C8 | C9 | H14 | 71.3° | 60.1° |
| H12 | C8 | C9 | H13 | 49.0° | 60.0° |
| H12 | C8 | C9 | H14 | 168.2° | 180.0° |
| H13 | C9 | C10 | H15 | 59.6° | 60.0° |
| H13 | C9 | C10 | H16 | 60.4° | 180.0° |
| H13 | C9 | C10 | H17 | 179.6° | 60.0° |
| H14 | C9 | C10 | H15 | 59.6° | 60.0° |
| H14 | C9 | C10 | H16 | 179.6° | 60.0° |
| H14 | C9 | C10 | H17 | 60.4° | 180.0° |
| H15 | C10 | H16 | H17 | 120.0° | 120.0° |
| H18 | C11 | C12 | H20 | 145.3° | 180.0° |
| H18 | C11 | C12 | H21 | 27.0° | 60.0° |
| H19 | C11 | C12 | H20 | 96.5° | 59.9° |
| H19 | C11 | C12 | H21 | 145.3° | 180.0° |
| H20 | C12 | C13 | H22 | 138.8° | 60.1° |
| H20 | C12 | C13 | H23 | 20.3° | 180.0° |
| H21 | C12 | C13 | H22 | 102.9° | 180.0° |
| H21 | C12 | C13 | H23 | 138.6° | 60.0° |
