2NV
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N1 | C2 | sing | 1.47Å | 1.45Å | |
| N1 | HN1 | sing | 1.01Å | 1.00Å | |
| N1 | HN1A | sing | 1.01Å | 1.00Å | |
| C3 | C2 | sing | 1.53Å | 1.53Å | |
| C2 | C2A | sing | 1.53Å | 1.54Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| O4 | C3 | sing | 1.43Å | 1.39Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| C3 | H3A | sing | 1.09Å | 1.10Å | |
| C5 | O4 | sing | 1.43Å | 1.42Å | |
| C5 | C6 | sing | 1.53Å | 1.54Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| C5 | H5A | sing | 1.09Å | 1.10Å | |
| O7 | C6 | sing | 1.43Å | 1.39Å | |
| C6 | H6 | sing | 1.09Å | 1.10Å | |
| C6 | H6A | sing | 1.09Å | 1.10Å | |
| O7 | C8 | sing | 1.43Å | 1.40Å | |
| C8 | C9 | sing | 1.53Å | 1.50Å | |
| C8 | H8 | sing | 1.09Å | 1.10Å | |
| C8 | H8A | sing | 1.09Å | 1.10Å | |
| O10 | C9 | sing | 1.43Å | 1.37Å | |
| C9 | H9 | sing | 1.09Å | 1.10Å | |
| C9 | H9A | sing | 1.09Å | 1.10Å | |
| O10 | C11 | sing | 1.43Å | 1.43Å | |
| C11 | C12 | sing | 1.53Å | 1.51Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C11 | H11A | sing | 1.09Å | 1.10Å | |
| C12 | O13 | sing | 1.43Å | 1.39Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H12A | sing | 1.09Å | 1.10Å | |
| O13 | C14 | sing | 1.43Å | 1.43Å | |
| C14 | C15 | sing | 1.53Å | 1.53Å | |
| C14 | H14 | sing | 1.09Å | 1.10Å | |
| C14 | H14A | sing | 1.09Å | 1.10Å | |
| C15 | O16 | sing | 1.43Å | 1.41Å | |
| C15 | H15 | sing | 1.09Å | 1.10Å | |
| C15 | H15A | sing | 1.09Å | 1.10Å | |
| O16 | C17 | sing | 1.43Å | 1.41Å | |
| C17 | C18 | sing | 1.53Å | 1.54Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| C17 | H17A | sing | 1.09Å | 1.10Å | |
| C18 | H18 | sing | 1.09Å | 1.10Å | |
| C18 | H18A | sing | 1.09Å | 1.10Å | |
| C18 | H18B | sing | 1.09Å | 1.10Å | |
| C2A | H2A | sing | 1.09Å | 1.10Å | |
| C2A | H2AA | sing | 1.09Å | 1.10Å | |
| C2A | H2AB | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | N1 | HN1 | 109.5° | 111.0° |
| C2 | N1 | HN1A | 109.5° | 111.0° |
| N1 | C2 | C3 | 105.8° | 109.5° |
| N1 | C2 | C2A | 106.1° | 109.4° |
| N1 | C2 | H2 | 111.4° | 109.5° |
| HN1 | N1 | HN1A | 109.5° | 111.0° |
| C3 | C2 | C2A | 112.8° | 109.5° |
| C3 | C2 | H2 | 110.3° | 109.5° |
| C2 | C3 | O4 | 113.0° | 109.5° |
| C2 | C3 | H3 | 108.6° | 109.5° |
| C2 | C3 | H3A | 108.6° | 109.5° |
| C2A | C2 | H2 | 110.2° | 109.5° |
| C2 | C2A | H2A | 109.5° | 109.5° |
| C2 | C2A | H2AA | 109.5° | 109.5° |
| C2 | C2A | H2AB | 109.5° | 109.4° |
| O4 | C3 | H3 | 108.6° | 109.4° |
| O4 | C3 | H3A | 108.6° | 109.5° |
| C3 | O4 | C5 | 115.8° | 114.0° |
| H3 | C3 | H3A | 109.5° | 109.4° |
| O4 | C5 | C6 | 110.9° | 109.4° |
| O4 | C5 | H5 | 109.1° | 109.5° |
| O4 | C5 | H5A | 109.1° | 109.5° |
| C6 | C5 | H5 | 109.1° | 109.5° |
| C6 | C5 | H5A | 109.1° | 109.5° |
| C5 | C6 | O7 | 108.8° | 109.4° |
| C5 | C6 | H6 | 109.6° | 109.4° |
| C5 | C6 | H6A | 109.6° | 109.5° |
| H5 | C5 | H5A | 109.5° | 109.5° |
| O7 | C6 | H6 | 109.6° | 109.4° |
| O7 | C6 | H6A | 109.7° | 109.5° |
| C6 | O7 | C8 | 114.7° | 114.0° |
| H6 | C6 | H6A | 109.5° | 109.5° |
| O7 | C8 | C9 | 106.8° | 109.5° |
| O7 | C8 | H8 | 110.2° | 109.5° |
| O7 | C8 | H8A | 110.1° | 109.4° |
| C9 | C8 | H8 | 110.1° | 109.5° |
| C9 | C8 | H8A | 110.2° | 109.4° |
| C8 | C9 | O10 | 110.7° | 109.5° |
| C8 | C9 | H9 | 109.2° | 109.4° |
| C8 | C9 | H9A | 109.2° | 109.5° |
| H8 | C8 | H8A | 109.5° | 109.5° |
| O10 | C9 | H9 | 109.2° | 109.5° |
| O10 | C9 | H9A | 109.2° | 109.5° |
| C9 | O10 | C11 | 111.6° | 114.0° |
| H9 | C9 | H9A | 109.5° | 109.5° |
| O10 | C11 | C12 | 105.7° | 109.5° |
| O10 | C11 | H11 | 110.4° | 109.5° |
| O10 | C11 | H11A | 110.4° | 109.5° |
| C12 | C11 | H11 | 110.4° | 109.4° |
| C12 | C11 | H11A | 110.4° | 109.4° |
| C11 | C12 | O13 | 117.2° | 109.5° |
| C11 | C12 | H12 | 107.5° | 109.5° |
| C11 | C12 | H12A | 107.5° | 109.5° |
| H11 | C11 | H11A | 109.5° | 109.5° |
| O13 | C12 | H12 | 107.5° | 109.4° |
| O13 | C12 | H12A | 107.5° | 109.5° |
| C12 | O13 | C14 | 114.4° | 114.0° |
| H12 | C12 | H12A | 109.4° | 109.4° |
| O13 | C14 | C15 | 107.7° | 109.5° |
| O13 | C14 | H14 | 109.9° | 109.5° |
| O13 | C14 | H14A | 109.9° | 109.5° |
| C15 | C14 | H14 | 109.9° | 109.5° |
| C15 | C14 | H14A | 109.9° | 109.5° |
| C14 | C15 | O16 | 114.9° | 109.5° |
| C14 | C15 | H15 | 108.1° | 109.5° |
| C14 | C15 | H15A | 108.1° | 109.5° |
| H14 | C14 | H14A | 109.5° | 109.4° |
| O16 | C15 | H15 | 108.1° | 109.5° |
| O16 | C15 | H15A | 108.1° | 109.4° |
| C15 | O16 | C17 | 114.6° | 114.0° |
| H15 | C15 | H15A | 109.5° | 109.4° |
| O16 | C17 | C18 | 110.6° | 109.5° |
| O16 | C17 | H17 | 109.2° | 109.5° |
| O16 | C17 | H17A | 109.2° | 109.4° |
| C18 | C17 | H17 | 109.2° | 109.5° |
| C18 | C17 | H17A | 109.2° | 109.4° |
| C17 | C18 | H18 | 109.5° | 109.4° |
| C17 | C18 | H18A | 109.5° | 109.4° |
| C17 | C18 | H18B | 109.4° | 109.5° |
| H17 | C17 | H17A | 109.5° | 109.5° |
| H18 | C18 | H18A | 109.4° | 109.5° |
| H18 | C18 | H18B | 109.5° | 109.5° |
| H18A | C18 | H18B | 109.5° | 109.5° |
| H2A | C2A | H2AA | 109.4° | 109.5° |
| H2A | C2A | H2AB | 109.5° | 109.5° |
| H2AA | C2A | H2AB | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | N1 | HN1 | HN1A | 120.0° | 123.9° |
| N1 | C2 | C3 | C2A | 115.6° | 120.0° |
| N1 | C2 | C3 | H2 | 120.7° | 120.0° |
| N1 | C2 | C2A | H2 | 120.8° | 120.0° |
| N1 | C2 | C3 | O4 | 155.2° | 65.0° |
| N1 | C2 | C3 | H3 | 34.7° | 55.0° |
| N1 | C2 | C3 | H3A | 84.2° | 175.0° |
| N1 | C2 | C2A | H2A | 180.0° | 60.0° |
| N1 | C2 | C2A | H2AA | 60.0° | 179.9° |
| N1 | C2 | C2A | H2AB | 60.0° | 60.0° |
| HN1 | N1 | C2 | C3 | 180.0° | 176.1° |
| HN1 | N1 | C2 | C2A | 59.9° | 63.9° |
| HN1 | N1 | C2 | H2 | 60.1° | 56.1° |
| HN1A | N1 | C2 | C3 | 60.0° | 60.0° |
| HN1A | N1 | C2 | C2A | 60.1° | 60.0° |
| HN1A | N1 | C2 | H2 | 179.9° | 180.0° |
| C3 | C2 | C2A | H2 | 123.8° | 120.0° |
| C2 | C3 | O4 | H3 | 120.5° | 120.0° |
| C2 | C3 | O4 | H3A | 120.5° | 120.0° |
| C2 | C3 | H3 | H3A | 118.4° | 120.0° |
| C2 | C3 | O4 | C5 | 163.4° | 180.0° |
| C3 | C2 | C2A | H2A | 64.5° | 180.0° |
| C3 | C2 | C2A | H2AA | 55.4° | 60.0° |
| C3 | C2 | C2A | H2AB | 175.5° | 60.0° |
| C2A | C2 | C3 | O4 | 89.2° | 175.0° |
| C2A | C2 | C3 | H3 | 150.3° | 65.0° |
| C2A | C2 | C3 | H3A | 31.4° | 55.0° |
| C2 | C2A | H2A | H2AA | 120.0° | 120.0° |
| C2 | C2A | H2A | H2AB | 120.0° | 120.0° |
| C2 | C2A | H2AA | H2AB | 120.0° | 119.9° |
| H2 | C2 | C3 | O4 | 34.6° | 55.0° |
| H2 | C2 | C3 | H3 | 85.9° | 175.0° |
| H2 | C2 | C3 | H3A | 155.1° | 65.0° |
| H2 | C2 | C2A | H2A | 59.2° | 60.0° |
| H2 | C2 | C2A | H2AA | 179.2° | 60.0° |
| H2 | C2 | C2A | H2AB | 60.8° | 180.0° |
| O4 | C3 | H3 | H3A | 118.4° | 120.0° |
| C3 | O4 | C5 | C6 | 65.2° | 179.9° |
| C3 | O4 | C5 | H5 | 174.5° | 60.0° |
| C3 | O4 | C5 | H5A | 55.0° | 60.0° |
| H3 | C3 | O4 | C5 | 76.1° | 60.0° |
| H3A | C3 | O4 | C5 | 42.9° | 60.0° |
| O4 | C5 | C6 | H5 | 120.2° | 120.0° |
| O4 | C5 | C6 | H5A | 120.2° | 120.0° |
| O4 | C5 | H5 | H5A | 119.4° | 120.0° |
| O4 | C5 | C6 | O7 | 171.4° | 65.0° |
| O4 | C5 | C6 | H6 | 51.5° | 175.0° |
| O4 | C5 | C6 | H6A | 68.7° | 55.0° |
| C6 | C5 | H5 | H5A | 119.3° | 120.0° |
| C5 | C6 | O7 | H6 | 119.9° | 119.9° |
| C5 | C6 | O7 | H6A | 119.9° | 120.0° |
| C5 | C6 | H6 | H6A | 120.3° | 120.1° |
| C5 | C6 | O7 | C8 | 176.9° | 179.9° |
| H5 | C5 | C6 | O7 | 68.4° | 55.0° |
| H5 | C5 | C6 | H6 | 171.7° | 65.0° |
| H5 | C5 | C6 | H6A | 51.5° | 175.0° |
| H5A | C5 | C6 | O7 | 51.1° | 175.0° |
| H5A | C5 | C6 | H6 | 68.7° | 55.1° |
| H5A | C5 | C6 | H6A | 171.0° | 65.0° |
| O7 | C6 | H6 | H6A | 120.3° | 120.0° |
| C6 | O7 | C8 | C9 | 81.9° | 180.0° |
| C6 | O7 | C8 | H8 | 158.5° | 60.0° |
| C6 | O7 | C8 | H8A | 37.6° | 60.0° |
| H6 | C6 | O7 | C8 | 57.0° | 60.0° |
| H6A | C6 | O7 | C8 | 63.2° | 60.0° |
| O7 | C8 | C9 | H8 | 119.6° | 120.0° |
| O7 | C8 | C9 | H8A | 119.6° | 119.9° |
| O7 | C8 | H8 | H8A | 121.2° | 120.0° |
| O7 | C8 | C9 | O10 | 73.4° | 65.1° |
| O7 | C8 | C9 | H9 | 166.4° | 175.0° |
| O7 | C8 | C9 | H9A | 46.7° | 55.0° |
| C9 | C8 | H8 | H8A | 121.3° | 120.0° |
| C8 | C9 | O10 | H9 | 120.2° | 120.0° |
| C8 | C9 | O10 | H9A | 120.2° | 120.0° |
| C8 | C9 | H9 | H9A | 119.5° | 120.0° |
| C8 | C9 | O10 | C11 | 151.6° | 180.0° |
| H8 | C8 | C9 | O10 | 46.2° | 55.0° |
| H8 | C8 | C9 | H9 | 74.0° | 65.0° |
| H8 | C8 | C9 | H9A | 166.3° | 175.0° |
| H8A | C8 | C9 | O10 | 167.0° | 175.0° |
| H8A | C8 | C9 | H9 | 46.8° | 55.0° |
| H8A | C8 | C9 | H9A | 72.8° | 65.0° |
| O10 | C9 | H9 | H9A | 119.4° | 120.0° |
| C9 | O10 | C11 | C12 | 76.0° | 180.0° |
| C9 | O10 | C11 | H11 | 164.6° | 60.1° |
| C9 | O10 | C11 | H11A | 43.4° | 60.0° |
| H9 | C9 | O10 | C11 | 31.4° | 60.0° |
| H9A | C9 | O10 | C11 | 88.2° | 60.0° |
| O10 | C11 | C12 | H11 | 119.4° | 120.0° |
| O10 | C11 | C12 | H11A | 119.4° | 120.0° |
| O10 | C11 | H11 | H11A | 121.8° | 120.1° |
| O10 | C11 | C12 | O13 | 169.8° | 65.0° |
| O10 | C11 | C12 | H12 | 48.7° | 175.0° |
| O10 | C11 | C12 | H12A | 69.1° | 55.0° |
| C12 | C11 | H11 | H11A | 121.7° | 119.9° |
| C11 | C12 | O13 | H12 | 121.1° | 120.0° |
| C11 | C12 | O13 | H12A | 121.1° | 120.1° |
| C11 | C12 | H12 | H12A | 116.5° | 120.0° |
| C11 | C12 | O13 | C14 | 169.8° | 180.0° |
| H11 | C11 | C12 | O13 | 70.8° | 55.0° |
| H11 | C11 | C12 | H12 | 168.1° | 65.0° |
| H11 | C11 | C12 | H12A | 50.4° | 175.0° |
| H11A | C11 | C12 | O13 | 50.4° | 175.0° |
| H11A | C11 | C12 | H12 | 70.7° | 55.0° |
| H11A | C11 | C12 | H12A | 171.5° | 65.0° |
| O13 | C12 | H12 | H12A | 116.5° | 120.0° |
| C12 | O13 | C14 | C15 | 75.3° | 180.0° |
| C12 | O13 | C14 | H14 | 44.5° | 60.0° |
| C12 | O13 | C14 | H14A | 165.0° | 59.9° |
| H12 | C12 | O13 | C14 | 48.6° | 60.0° |
| H12A | C12 | O13 | C14 | 69.1° | 59.9° |
| O13 | C14 | C15 | H14 | 119.7° | 120.0° |
| O13 | C14 | C15 | H14A | 119.7° | 120.1° |
| O13 | C14 | H14 | H14A | 120.8° | 120.0° |
| O13 | C14 | C15 | O16 | 178.0° | 64.9° |
| O13 | C14 | C15 | H15 | 57.2° | 175.0° |
| O13 | C14 | C15 | H15A | 61.2° | 55.0° |
| C15 | C14 | H14 | H14A | 120.8° | 120.0° |
| C14 | C15 | O16 | H15 | 120.8° | 120.1° |
| C14 | C15 | O16 | H15A | 120.8° | 120.0° |
| C14 | C15 | H15 | H15A | 117.5° | 120.0° |
| C14 | C15 | O16 | C17 | 179.7° | 180.0° |
| H14 | C14 | C15 | O16 | 62.3° | 55.1° |
| H14 | C14 | C15 | H15 | 176.9° | 65.0° |
| H14 | C14 | C15 | H15A | 58.5° | 175.0° |
| H14A | C14 | C15 | O16 | 58.3° | 175.0° |
| H14A | C14 | C15 | H15 | 62.5° | 54.9° |
| H14A | C14 | C15 | H15A | 179.1° | 65.0° |
| O16 | C15 | H15 | H15A | 117.5° | 120.0° |
| C15 | O16 | C17 | C18 | 88.1° | 180.0° |
| C15 | O16 | C17 | H17 | 32.1° | 59.9° |
| C15 | O16 | C17 | H17A | 151.8° | 60.1° |
| H15 | C15 | O16 | C17 | 59.5° | 59.9° |
| H15A | C15 | O16 | C17 | 58.9° | 60.0° |
| O16 | C17 | C18 | H17 | 120.1° | 120.1° |
| O16 | C17 | C18 | H17A | 120.2° | 119.9° |
| O16 | C17 | H17 | H17A | 119.5° | 120.0° |
| O16 | C17 | C18 | H18 | 180.0° | 59.9° |
| O16 | C17 | C18 | H18A | 60.0° | 60.1° |
| O16 | C17 | C18 | H18B | 60.0° | 179.9° |
| C18 | C17 | H17 | H17A | 119.5° | 120.0° |
| C17 | C18 | H18 | H18A | 120.0° | 120.0° |
| C17 | C18 | H18 | H18B | 120.0° | 120.0° |
| C17 | C18 | H18A | H18B | 120.0° | 120.0° |
| H17 | C17 | C18 | H18 | 59.8° | 180.0° |
| H17 | C17 | C18 | H18A | 179.8° | 60.0° |
| H17 | C17 | C18 | H18B | 60.2° | 60.0° |
| H17A | C17 | C18 | H18 | 59.8° | 60.0° |
| H17A | C17 | C18 | H18A | 60.2° | 180.0° |
| H17A | C17 | C18 | H18B | 179.9° | 60.0° |
| H18 | C18 | H18A | H18B | 120.0° | 120.1° |
| H2A | C2A | H2AA | H2AB | 120.0° | 120.0° |
