HPN
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N1 | C1 | sing | 1.35Å | 1.25Å | |
| N1 | HN11 | sing | 0.97Å | 1.02Å | |
| N1 | HN12 | sing | 0.97Å | 1.02Å | |
| C1 | O1 | doub | 1.21Å | 1.26Å | |
| C1 | C2 | sing | 1.51Å | 1.45Å | |
| C2 | C3 | sing | 1.53Å | 1.50Å | |
| C2 | H21 | sing | 1.09Å | 1.11Å | |
| C2 | H22 | sing | 1.09Å | 1.11Å | |
| C3 | C4 | sing | 1.53Å | 1.51Å | |
| C3 | H31 | sing | 1.09Å | 1.12Å | |
| C3 | H32 | sing | 1.09Å | 1.12Å | |
| C4 | C5 | sing | 1.53Å | 1.49Å | |
| C4 | H41 | sing | 1.09Å | 1.11Å | |
| C4 | H42 | sing | 1.09Å | 1.11Å | |
| C5 | C6 | sing | 1.53Å | 1.51Å | |
| C5 | H51 | sing | 1.09Å | 1.11Å | |
| C5 | H52 | sing | 1.09Å | 1.12Å | |
| C6 | C7 | sing | 1.53Å | 1.51Å | |
| C6 | H61 | sing | 1.09Å | 1.12Å | |
| C6 | H62 | sing | 1.09Å | 1.11Å | |
| C7 | H71 | sing | 1.09Å | 1.12Å | |
| C7 | H72 | sing | 1.09Å | 1.11Å | |
| C7 | H73 | sing | 1.09Å | 1.12Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C1 | N1 | HN11 | 117.6° | 120.1° |
| C1 | N1 | HN12 | 120.9° | 119.9° |
| N1 | C1 | O1 | 120.9° | 119.9° |
| N1 | C1 | C2 | 117.6° | 120.1° |
| HN11 | N1 | HN12 | 121.5° | 120.0° |
| O1 | C1 | C2 | 121.5° | 120.0° |
| C1 | C2 | C3 | 105.7° | 109.5° |
| C1 | C2 | H21 | 113.6° | 109.5° |
| C1 | C2 | H22 | 113.6° | 109.5° |
| C3 | C2 | H21 | 113.6° | 109.4° |
| C3 | C2 | H22 | 113.6° | 109.4° |
| C2 | C3 | C4 | 103.7° | 109.5° |
| C2 | C3 | H31 | 114.4° | 109.5° |
| C2 | C3 | H32 | 114.4° | 109.5° |
| H21 | C2 | H22 | 96.9° | 109.4° |
| C4 | C3 | H31 | 114.4° | 109.4° |
| C4 | C3 | H32 | 114.4° | 109.4° |
| C3 | C4 | C5 | 109.3° | 109.5° |
| C3 | C4 | H41 | 112.3° | 109.5° |
| C3 | C4 | H42 | 112.3° | 109.5° |
| H31 | C3 | H32 | 96.0° | 109.5° |
| C5 | C4 | H41 | 112.2° | 109.4° |
| C5 | C4 | H42 | 112.3° | 109.4° |
| C4 | C5 | C6 | 115.4° | 109.5° |
| C4 | C5 | H51 | 110.1° | 109.5° |
| C4 | C5 | H52 | 110.1° | 109.5° |
| H41 | C4 | H42 | 98.2° | 109.5° |
| C6 | C5 | H51 | 110.0° | 109.4° |
| C6 | C5 | H52 | 110.0° | 109.4° |
| C5 | C6 | C7 | 115.1° | 109.5° |
| C5 | C6 | H61 | 110.2° | 109.5° |
| C5 | C6 | H62 | 110.2° | 109.5° |
| H51 | C5 | H52 | 100.1° | 109.4° |
| C7 | C6 | H61 | 110.1° | 109.4° |
| C7 | C6 | H62 | 110.2° | 109.4° |
| C6 | C7 | H71 | 115.1° | 109.6° |
| C6 | C7 | H72 | 110.2° | 109.5° |
| C6 | C7 | H73 | 110.2° | 109.5° |
| H61 | C6 | H62 | 100.0° | 109.5° |
| H71 | C7 | H72 | 110.2° | 109.4° |
| H71 | C7 | H73 | 110.1° | 109.4° |
| H72 | C7 | H73 | 100.1° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C1 | N1 | HN11 | HN12 | 178.6° | 180.0° |
| N1 | C1 | O1 | C2 | 178.6° | 180.0° |
| N1 | C1 | C2 | C3 | 96.2° | 180.0° |
| N1 | C1 | C2 | H21 | 138.6° | 60.0° |
| N1 | C1 | C2 | H22 | 29.1° | 60.0° |
| HN11 | N1 | C1 | O1 | 1.3° | 0.0° |
| HN11 | N1 | C1 | C2 | 180.0° | 180.0° |
| HN12 | N1 | C1 | O1 | 179.9° | 180.0° |
| HN12 | N1 | C1 | C2 | 1.4° | 0.0° |
| O1 | C1 | C2 | C3 | 85.1° | 0.0° |
| O1 | C1 | C2 | H21 | 40.1° | 120.0° |
| O1 | C1 | C2 | H22 | 149.6° | 120.0° |
| C1 | C2 | C3 | H21 | 125.2° | 120.0° |
| C1 | C2 | C3 | H22 | 125.3° | 120.0° |
| C1 | C2 | H21 | H22 | 119.6° | 120.0° |
| C1 | C2 | C3 | C4 | 168.9° | 180.0° |
| C1 | C2 | C3 | H31 | 65.9° | 60.0° |
| C1 | C2 | C3 | H32 | 43.6° | 60.0° |
| C3 | C2 | H21 | H22 | 119.5° | 119.9° |
| C2 | C3 | C4 | H31 | 125.3° | 120.0° |
| C2 | C3 | C4 | H32 | 125.3° | 120.0° |
| C2 | C3 | H31 | H32 | 120.3° | 120.0° |
| C2 | C3 | C4 | C5 | 153.7° | 180.0° |
| C2 | C3 | C4 | H41 | 81.1° | 60.0° |
| C2 | C3 | C4 | H42 | 28.4° | 60.0° |
| H21 | C2 | C3 | C4 | 43.7° | 60.0° |
| H21 | C2 | C3 | H31 | 168.9° | 179.9° |
| H21 | C2 | C3 | H32 | 81.6° | 60.0° |
| H22 | C2 | C3 | C4 | 65.8° | 60.0° |
| H22 | C2 | C3 | H31 | 59.4° | 60.0° |
| H22 | C2 | C3 | H32 | 168.9° | 179.9° |
| C4 | C3 | H31 | H32 | 120.3° | 120.0° |
| C3 | C4 | C5 | H41 | 125.3° | 120.0° |
| C3 | C4 | C5 | H42 | 125.3° | 120.0° |
| C3 | C4 | H41 | H42 | 118.2° | 120.1° |
| C3 | C4 | C5 | C6 | 155.8° | 180.0° |
| C3 | C4 | C5 | H51 | 79.0° | 60.0° |
| C3 | C4 | C5 | H52 | 30.5° | 60.0° |
| H31 | C3 | C4 | C5 | 28.4° | 60.0° |
| H31 | C3 | C4 | H41 | 153.6° | 180.0° |
| H31 | C3 | C4 | H42 | 96.9° | 59.9° |
| H32 | C3 | C4 | C5 | 81.0° | 60.0° |
| H32 | C3 | C4 | H41 | 44.2° | 59.9° |
| H32 | C3 | C4 | H42 | 153.7° | 180.0° |
| C5 | C4 | H41 | H42 | 118.2° | 119.9° |
| C4 | C5 | C6 | H51 | 125.3° | 120.0° |
| C4 | C5 | C6 | H52 | 125.3° | 120.0° |
| C4 | C5 | H51 | H52 | 115.9° | 120.0° |
| C4 | C5 | C6 | C7 | 134.0° | 180.0° |
| C4 | C5 | C6 | H61 | 100.8° | 60.0° |
| C4 | C5 | C6 | H62 | 8.6° | 60.0° |
| H41 | C4 | C5 | C6 | 30.5° | 60.0° |
| H41 | C4 | C5 | H51 | 155.8° | 180.0° |
| H41 | C4 | C5 | H52 | 94.7° | 60.0° |
| H42 | C4 | C5 | C6 | 79.0° | 60.0° |
| H42 | C4 | C5 | H51 | 46.3° | 60.0° |
| H42 | C4 | C5 | H52 | 155.8° | 180.0° |
| C6 | C5 | H51 | H52 | 115.8° | 119.9° |
| C5 | C6 | C7 | H61 | 125.3° | 120.0° |
| C5 | C6 | C7 | H62 | 125.3° | 120.0° |
| C5 | C6 | H61 | H62 | 116.0° | 120.0° |
| C5 | C6 | C7 | H71 | 180.0° | 180.0° |
| C5 | C6 | C7 | H72 | 54.7° | 60.0° |
| C5 | C6 | C7 | H73 | 54.8° | 60.0° |
| H51 | C5 | C6 | C7 | 8.6° | 60.0° |
| H51 | C5 | C6 | H61 | 133.9° | 179.9° |
| H51 | C5 | C6 | H62 | 116.7° | 60.0° |
| H52 | C5 | C6 | C7 | 100.8° | 60.0° |
| H52 | C5 | C6 | H61 | 24.5° | 60.0° |
| H52 | C5 | C6 | H62 | 133.9° | 179.9° |
| C7 | C6 | H61 | H62 | 116.0° | 119.9° |
| C6 | C7 | H71 | H72 | 125.3° | 120.0° |
| C6 | C7 | H71 | H73 | 125.2° | 120.0° |
| C6 | C7 | H72 | H73 | 116.0° | 120.0° |
| H61 | C6 | C7 | H71 | 54.7° | 60.0° |
| H61 | C6 | C7 | H72 | 180.0° | 60.0° |
| H61 | C6 | C7 | H73 | 70.5° | 180.0° |
| H62 | C6 | C7 | H71 | 54.7° | 60.0° |
| H62 | C6 | C7 | H72 | 70.6° | 180.0° |
| H62 | C6 | C7 | H73 | 179.9° | 60.0° |
| H71 | C7 | H72 | H73 | 116.0° | 119.9° |
