UH5
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N | C | sing | 1.47Å | 1.45Å | |
| C1 | C | sing | 1.53Å | 1.52Å | |
| C1 | C2 | sing | 1.53Å | 1.51Å | |
| C2 | O | sing | 1.43Å | 1.43Å | |
| O | C3 | sing | 1.43Å | 1.40Å | |
| C5 | C4 | sing | 1.53Å | 1.52Å | |
| C5 | O2 | sing | 1.43Å | 1.41Å | |
| C4 | O1 | sing | 1.43Å | 1.44Å | |
| C4 | C6 | sing | 1.53Å | 1.53Å | |
| C3 | O1 | sing | 1.43Å | 1.41Å | |
| C3 | C8 | sing | 1.53Å | 1.53Å | |
| O3 | C6 | sing | 1.43Å | 1.42Å | |
| C8 | C7 | sing | 1.53Å | 1.53Å | |
| C8 | N1 | sing | 1.46Å | 1.47Å | |
| C6 | C7 | sing | 1.53Å | 1.52Å | |
| C7 | O4 | sing | 1.43Å | 1.43Å | |
| N1 | C9 | sing | 1.35Å | 1.34Å | Aromatic |
| N1 | N3 | sing | 1.29Å | 1.35Å | Aromatic |
| C9 | C10 | doub | 1.37Å | 1.37Å | Aromatic |
| N3 | N2 | doub | 1.29Å | 1.31Å | Aromatic |
| C10 | N2 | sing | 1.35Å | 1.36Å | Aromatic |
| C10 | C11 | sing | 1.48Å | 1.47Å | |
| C16 | C11 | doub | 1.39Å | 1.39Å | Aromatic |
| C16 | C15 | sing | 1.38Å | 1.38Å | Aromatic |
| C11 | C12 | sing | 1.39Å | 1.39Å | Aromatic |
| C15 | C14 | doub | 1.38Å | 1.38Å | Aromatic |
| C12 | C13 | doub | 1.38Å | 1.38Å | Aromatic |
| C14 | C13 | sing | 1.38Å | 1.38Å | Aromatic |
| C7 | H15 | sing | 1.09Å | 1.10Å | |
| C8 | H17 | sing | 1.09Å | 1.10Å | |
| C9 | H18 | sing | 1.08Å | 1.08Å | |
| C1 | H5 | sing | 1.09Å | 1.10Å | |
| C1 | H4 | sing | 1.09Å | 1.10Å | |
| C5 | H10 | sing | 1.09Å | 1.10Å | |
| C5 | H11 | sing | 1.09Å | 1.10Å | |
| C6 | H13 | sing | 1.09Å | 1.10Å | |
| C4 | H9 | sing | 1.09Å | 1.10Å | |
| O4 | H16 | sing | 0.97Å | 0.95Å | |
| C3 | H8 | sing | 1.09Å | 1.10Å | |
| O3 | H14 | sing | 0.97Å | 0.95Å | |
| C2 | H7 | sing | 1.09Å | 1.10Å | |
| C2 | H6 | sing | 1.09Å | 1.10Å | |
| N | H24 | sing | 1.01Å | 1.00Å | |
| N | H1 | sing | 1.01Å | 1.00Å | |
| C | H3 | sing | 1.09Å | 1.10Å | |
| C | H2 | sing | 1.09Å | 1.10Å | |
| C12 | H19 | sing | 1.08Å | 1.08Å | |
| C13 | H20 | sing | 1.08Å | 1.08Å | |
| C14 | H21 | sing | 1.08Å | 1.08Å | |
| C15 | H22 | sing | 1.08Å | 1.08Å | |
| C16 | H23 | sing | 1.08Å | 1.08Å | |
| O2 | H12 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N | C | C1 | 114.1° | 109.5° |
| C | N | H24 | 109.5° | 111.0° |
| C | N | H1 | 109.5° | 111.0° |
| N | C | H3 | 108.3° | 109.5° |
| N | C | H2 | 108.3° | 109.4° |
| C | C1 | C2 | 113.0° | 109.5° |
| C | C1 | H5 | 108.6° | 109.5° |
| C | C1 | H4 | 108.6° | 109.5° |
| C1 | C | H3 | 108.3° | 109.5° |
| C1 | C | H2 | 108.3° | 109.5° |
| C1 | C2 | O | 109.4° | 109.5° |
| C2 | C1 | H5 | 108.6° | 109.5° |
| C2 | C1 | H4 | 108.6° | 109.5° |
| C1 | C2 | H7 | 109.5° | 109.5° |
| C1 | C2 | H6 | 109.5° | 109.5° |
| C2 | O | C3 | 114.4° | 114.0° |
| O | C2 | H7 | 109.5° | 109.4° |
| O | C2 | H6 | 109.5° | 109.4° |
| O | C3 | O1 | 110.5° | 109.5° |
| O | C3 | C8 | 103.6° | 109.5° |
| O | C3 | H8 | 111.2° | 109.5° |
| C4 | C5 | O2 | 111.9° | 109.5° |
| C5 | C4 | O1 | 106.9° | 109.5° |
| C5 | C4 | C6 | 113.7° | 109.5° |
| C4 | C5 | H10 | 108.8° | 109.5° |
| C4 | C5 | H11 | 108.8° | 109.5° |
| C5 | C4 | H9 | 108.7° | 109.4° |
| O2 | C5 | H10 | 108.8° | 109.5° |
| O2 | C5 | H11 | 108.9° | 109.4° |
| C5 | O2 | H12 | 109.5° | 114.0° |
| O1 | C4 | C6 | 109.2° | 109.4° |
| C4 | O1 | C3 | 113.2° | 114.0° |
| O1 | C4 | H9 | 109.8° | 109.5° |
| C4 | C6 | O3 | 110.6° | 109.6° |
| C4 | C6 | C7 | 109.6° | 109.2° |
| C4 | C6 | H13 | 108.9° | 109.5° |
| C6 | C4 | H9 | 108.6° | 109.5° |
| O1 | C3 | C8 | 110.9° | 109.4° |
| O1 | C3 | H8 | 111.0° | 109.4° |
| C3 | C8 | C7 | 111.9° | 109.1° |
| C3 | C8 | N1 | 110.0° | 109.5° |
| C3 | C8 | H17 | 108.5° | 109.6° |
| C8 | C3 | H8 | 109.3° | 109.5° |
| O3 | C6 | C7 | 108.5° | 109.5° |
| O3 | C6 | H13 | 110.3° | 109.5° |
| C6 | O3 | H14 | 109.5° | 114.0° |
| C7 | C8 | N1 | 108.7° | 109.5° |
| C8 | C7 | C6 | 111.3° | 109.1° |
| C8 | C7 | O4 | 110.4° | 109.5° |
| C8 | C7 | H15 | 108.2° | 109.5° |
| C7 | C8 | H17 | 108.5° | 109.5° |
| C8 | N1 | C9 | 128.7° | 125.8° |
| C8 | N1 | N3 | 120.3° | 125.7° |
| N1 | C8 | H17 | 109.3° | 109.6° |
| C6 | C7 | O4 | 109.0° | 109.6° |
| C6 | C7 | H15 | 108.3° | 109.6° |
| C7 | C6 | H13 | 108.9° | 109.6° |
| O4 | C7 | H15 | 109.6° | 109.5° |
| C7 | O4 | H16 | 109.5° | 114.0° |
| C9 | N1 | N3 | 110.9° | 108.5° |
| N1 | C9 | C10 | 105.4° | 106.0° |
| N1 | C9 | H18 | 127.3° | 127.0° |
| N1 | N3 | N2 | 106.5° | 110.5° |
| C9 | C10 | N2 | 107.3° | 106.2° |
| C9 | C10 | C11 | 130.2° | 126.9° |
| C10 | C9 | H18 | 127.3° | 126.9° |
| N3 | N2 | C10 | 109.9° | 108.8° |
| N2 | C10 | C11 | 122.5° | 126.9° |
| C10 | C11 | C16 | 120.9° | 120.1° |
| C10 | C11 | C12 | 120.5° | 120.1° |
| C11 | C16 | C15 | 120.5° | 119.9° |
| C16 | C11 | C12 | 118.6° | 119.8° |
| C11 | C16 | H23 | 119.7° | 120.1° |
| C16 | C15 | C14 | 120.2° | 120.2° |
| C16 | C15 | H22 | 119.9° | 119.9° |
| C15 | C16 | H23 | 119.7° | 120.1° |
| C11 | C12 | C13 | 120.5° | 119.9° |
| C11 | C12 | H19 | 119.8° | 120.1° |
| C15 | C14 | C13 | 119.9° | 120.2° |
| C15 | C14 | H21 | 120.1° | 119.9° |
| C14 | C15 | H22 | 119.9° | 119.9° |
| C12 | C13 | C14 | 120.3° | 120.1° |
| C13 | C12 | H19 | 119.7° | 120.0° |
| C12 | C13 | H20 | 119.9° | 120.0° |
| C14 | C13 | H20 | 119.9° | 119.9° |
| C13 | C14 | H21 | 120.0° | 119.9° |
| H5 | C1 | H4 | 109.5° | 109.5° |
| H10 | C5 | H11 | 109.5° | 109.5° |
| H7 | C2 | H6 | 109.5° | 109.5° |
| H24 | N | H1 | 109.5° | 111.1° |
| H3 | C | H2 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N | C | C1 | H3 | 120.7° | 120.0° |
| N | C | C1 | H2 | 120.7° | 120.0° |
| N | C | C1 | C2 | 175.6° | 180.0° |
| N | C | C1 | H5 | 55.1° | 60.0° |
| N | C | C1 | H4 | 63.8° | 60.0° |
| C | N | H24 | H1 | 120.0° | 124.0° |
| N | C | H3 | H2 | 117.9° | 119.9° |
| C | C1 | C2 | H5 | 120.5° | 120.0° |
| C | C1 | C2 | H4 | 120.5° | 120.0° |
| C | C1 | C2 | O | 71.2° | 180.0° |
| C | C1 | H5 | H4 | 118.4° | 120.0° |
| C | C1 | C2 | H7 | 168.8° | 60.0° |
| C | C1 | C2 | H6 | 48.8° | 60.1° |
| C1 | C | N | H24 | 180.0° | 180.0° |
| C1 | C | N | H1 | 60.0° | 56.0° |
| C1 | C | H3 | H2 | 117.9° | 120.1° |
| C1 | C2 | O | H7 | 120.0° | 120.0° |
| C1 | C2 | O | H6 | 120.0° | 120.0° |
| C1 | C2 | O | C3 | 166.7° | 180.0° |
| C2 | C1 | H5 | H4 | 118.4° | 120.0° |
| C1 | C2 | H7 | H6 | 120.0° | 120.1° |
| C2 | C1 | C | H3 | 63.7° | 60.0° |
| C2 | C1 | C | H2 | 54.9° | 60.0° |
| C2 | O | C3 | O1 | 61.5° | 70.0° |
| C2 | O | C3 | C8 | 179.7° | 170.0° |
| O | C2 | C1 | H5 | 49.3° | 60.0° |
| O | C2 | C1 | H4 | 168.3° | 60.0° |
| C2 | O | C3 | H8 | 62.3° | 50.0° |
| O | C2 | H7 | H6 | 120.0° | 119.9° |
| O | C3 | O1 | C4 | 54.2° | 58.9° |
| O | C3 | O1 | C8 | 114.4° | 120.1° |
| O | C3 | O1 | H8 | 123.9° | 120.0° |
| O | C3 | C8 | H8 | 118.7° | 120.0° |
| O | C3 | C8 | C7 | 67.8° | 62.4° |
| O | C3 | C8 | N1 | 171.3° | 177.7° |
| O | C3 | C8 | H17 | 51.8° | 57.5° |
| C3 | O | C2 | H7 | 73.3° | 60.0° |
| C3 | O | C2 | H6 | 46.8° | 60.0° |
| C4 | C5 | O2 | H10 | 120.4° | 120.0° |
| C4 | C5 | O2 | H11 | 120.4° | 120.0° |
| C5 | C4 | O1 | C6 | 123.4° | 120.0° |
| C5 | C4 | O1 | H9 | 117.7° | 120.0° |
| C5 | C4 | C6 | H9 | 121.1° | 120.0° |
| C5 | C4 | O1 | C3 | 172.1° | 178.8° |
| C5 | C4 | C6 | O3 | 62.5° | 62.5° |
| C5 | C4 | C6 | C7 | 178.0° | 177.6° |
| C4 | C5 | H10 | H11 | 118.9° | 120.0° |
| C5 | C4 | C6 | H13 | 58.9° | 57.7° |
| C4 | C5 | O2 | H12 | 180.0° | 180.0° |
| O2 | C5 | C4 | O1 | 68.6° | 65.0° |
| O2 | C5 | C4 | C6 | 52.0° | 175.1° |
| O2 | C5 | H10 | H11 | 118.9° | 119.9° |
| O2 | C5 | C4 | H9 | 173.0° | 55.0° |
| O1 | C4 | C6 | H9 | 119.7° | 120.0° |
| C4 | O1 | C3 | C8 | 60.2° | 61.2° |
| O1 | C4 | C6 | O3 | 178.3° | 177.5° |
| O1 | C4 | C6 | C7 | 58.7° | 57.6° |
| O1 | C4 | C5 | H10 | 51.8° | 175.0° |
| O1 | C4 | C5 | H11 | 171.0° | 55.0° |
| O1 | C4 | C6 | H13 | 60.3° | 62.3° |
| C4 | O1 | C3 | H8 | 178.1° | 178.8° |
| C6 | C4 | O1 | C3 | 64.6° | 61.2° |
| C4 | C6 | O3 | C7 | 120.2° | 119.7° |
| C4 | C6 | O3 | H13 | 120.6° | 120.2° |
| C4 | C6 | C7 | C8 | 51.7° | 57.0° |
| C4 | C6 | C7 | H13 | 119.0° | 119.9° |
| C4 | C6 | C7 | O4 | 173.7° | 176.8° |
| C4 | C6 | C7 | H15 | 67.1° | 62.9° |
| C6 | C4 | C5 | H10 | 172.3° | 55.1° |
| C6 | C4 | C5 | H11 | 68.4° | 65.0° |
| C4 | C6 | O3 | H14 | 180.0° | 60.3° |
| O1 | C3 | C8 | H8 | 122.7° | 119.9° |
| O1 | C3 | C8 | C7 | 50.8° | 57.6° |
| O1 | C3 | C8 | N1 | 70.1° | 62.3° |
| O1 | C3 | C8 | H17 | 170.4° | 177.5° |
| C3 | O1 | C4 | H9 | 54.4° | 58.9° |
| C3 | C8 | C7 | N1 | 121.7° | 119.9° |
| C3 | C8 | C7 | H17 | 119.6° | 120.0° |
| C3 | C8 | N1 | H17 | 119.0° | 120.2° |
| C3 | C8 | C7 | C6 | 47.9° | 56.9° |
| C3 | C8 | C7 | O4 | 169.1° | 176.9° |
| C3 | C8 | N1 | C9 | 39.1° | 34.7° |
| C3 | C8 | N1 | N3 | 144.5° | 145.6° |
| C3 | C8 | C7 | H15 | 71.0° | 63.0° |
| O3 | C6 | C7 | C8 | 172.6° | 176.9° |
| O3 | C6 | C7 | H13 | 120.1° | 120.1° |
| O3 | C6 | C7 | O4 | 65.5° | 63.2° |
| O3 | C6 | C7 | H15 | 53.7° | 57.0° |
| O3 | C6 | C4 | H9 | 58.6° | 57.5° |
| C7 | C8 | N1 | H17 | 118.2° | 120.2° |
| C8 | C7 | C6 | O4 | 122.0° | 119.9° |
| C8 | C7 | C6 | H15 | 118.8° | 119.9° |
| C8 | C7 | O4 | H15 | 119.1° | 120.1° |
| C7 | C8 | N1 | C9 | 83.8° | 84.9° |
| C7 | C8 | N1 | N3 | 92.7° | 94.7° |
| C8 | C7 | C6 | H13 | 67.3° | 63.0° |
| C8 | C7 | O4 | H16 | 180.0° | 179.8° |
| C7 | C8 | C3 | H8 | 173.5° | 177.5° |
| N1 | C8 | C7 | C6 | 73.8° | 62.9° |
| N1 | C8 | C7 | O4 | 47.4° | 57.0° |
| C8 | N1 | C9 | N3 | 176.7° | 179.7° |
| C8 | N1 | C9 | C10 | 176.2° | 179.7° |
| C8 | N1 | N3 | N2 | 176.4° | 179.7° |
| N1 | C8 | C7 | H15 | 167.3° | 177.1° |
| C8 | N1 | C9 | H18 | 3.8° | 0.4° |
| N1 | C8 | C3 | H8 | 52.6° | 57.6° |
| C6 | C7 | O4 | H15 | 118.4° | 120.3° |
| C6 | C7 | C8 | H17 | 167.5° | 176.9° |
| C7 | C6 | C4 | H9 | 61.0° | 62.4° |
| C6 | C7 | O4 | H16 | 57.5° | 60.2° |
| C7 | C6 | O3 | H14 | 59.8° | 180.0° |
| O4 | C7 | C8 | H17 | 71.3° | 63.2° |
| O4 | C7 | C6 | H13 | 54.7° | 56.9° |
| N1 | C9 | C10 | H18 | 180.0° | 179.9° |
| C9 | N1 | N3 | N2 | 0.6° | 0.0° |
| N1 | C9 | C10 | N2 | 0.2° | 0.0° |
| N1 | C9 | C10 | C11 | 178.5° | 180.0° |
| C9 | N1 | C8 | H17 | 158.0° | 154.9° |
| N3 | N1 | C9 | C10 | 0.5° | 0.0° |
| N1 | N3 | N2 | C10 | 0.5° | 0.0° |
| N3 | N1 | C8 | H17 | 25.5° | 25.4° |
| N3 | N1 | C9 | H18 | 179.5° | 179.9° |
| C9 | C10 | N2 | N3 | 0.2° | 0.0° |
| C9 | C10 | N2 | C11 | 178.5° | 180.0° |
| C9 | C10 | C11 | C16 | 10.3° | 0.3° |
| C9 | C10 | C11 | C12 | 172.8° | 180.0° |
| N3 | N2 | C10 | C11 | 178.3° | 180.0° |
| N2 | C10 | C11 | C16 | 167.8° | 179.7° |
| N2 | C10 | C11 | C12 | 9.2° | 0.0° |
| N2 | C10 | C9 | H18 | 179.8° | 179.9° |
| C10 | C11 | C16 | C12 | 177.0° | 179.8° |
| C10 | C11 | C16 | C15 | 176.0° | 179.7° |
| C10 | C11 | C12 | C13 | 176.0° | 180.0° |
| C11 | C10 | C9 | H18 | 1.5° | 0.1° |
| C10 | C11 | C12 | H19 | 4.0° | 0.0° |
| C10 | C11 | C16 | H23 | 4.0° | 0.0° |
| C11 | C16 | C15 | H23 | 180.0° | 179.7° |
| C11 | C16 | C15 | C14 | 0.2° | 0.6° |
| C16 | C11 | C12 | C13 | 1.1° | 0.2° |
| C16 | C11 | C12 | H19 | 178.9° | 179.7° |
| C11 | C16 | C15 | H22 | 179.7° | 179.7° |
| C15 | C16 | C11 | C12 | 1.0° | 0.5° |
| C16 | C15 | C14 | H22 | 180.0° | 179.7° |
| C16 | C15 | C14 | C13 | 0.5° | 0.3° |
| C16 | C15 | C14 | H21 | 179.5° | 179.7° |
| C11 | C12 | C13 | H19 | 180.0° | 179.9° |
| C11 | C12 | C13 | C14 | 0.3° | 0.0° |
| C11 | C12 | C13 | H20 | 179.7° | 180.0° |
| C12 | C11 | C16 | H23 | 179.0° | 179.8° |
| C15 | C14 | C13 | C12 | 0.5° | 0.0° |
| C15 | C14 | C13 | H21 | 180.0° | 180.0° |
| C15 | C14 | C13 | H20 | 179.5° | 180.0° |
| C14 | C15 | C16 | H23 | 179.8° | 179.7° |
| C12 | C13 | C14 | H20 | 180.0° | 180.0° |
| C12 | C13 | C14 | H21 | 179.6° | 180.0° |
| C14 | C13 | C12 | H19 | 179.7° | 180.0° |
| C13 | C14 | C15 | H22 | 179.5° | 179.9° |
| H15 | C7 | C8 | H17 | 48.6° | 57.0° |
| H15 | C7 | C6 | H13 | 173.8° | 177.1° |
| H15 | C7 | O4 | H16 | 60.9° | 60.1° |
| H17 | C8 | C3 | H8 | 66.9° | 62.5° |
| H5 | C1 | C2 | H7 | 70.7° | 60.0° |
| H5 | C1 | C2 | H6 | 169.3° | 180.0° |
| H5 | C1 | C | H3 | 175.8° | 180.0° |
| H5 | C1 | C | H2 | 65.6° | 59.9° |
| H4 | C1 | C2 | H7 | 48.3° | 180.0° |
| H4 | C1 | C2 | H6 | 71.8° | 59.9° |
| H4 | C1 | C | H3 | 56.8° | 60.0° |
| H4 | C1 | C | H2 | 175.5° | 180.0° |
| H10 | C5 | C4 | H9 | 66.7° | 65.0° |
| H10 | C5 | O2 | H12 | 59.6° | 60.0° |
| H11 | C5 | C4 | H9 | 52.6° | 175.0° |
| H11 | C5 | O2 | H12 | 59.6° | 60.0° |
| H13 | C6 | C4 | H9 | 180.0° | 177.7° |
| H13 | C6 | O3 | H14 | 59.4° | 59.8° |
| H24 | N | C | H3 | 59.3° | 60.0° |
| H24 | N | C | H2 | 59.3° | 60.0° |
| H1 | N | C | H3 | 60.7° | 176.0° |
| H1 | N | C | H2 | 179.4° | 64.0° |
| H19 | C12 | C13 | H20 | 0.3° | 0.0° |
| H20 | C13 | C14 | H21 | 0.5° | 0.0° |
| H21 | C14 | C15 | H22 | 0.4° | 0.0° |
| H22 | C15 | C16 | H23 | 0.2° | 0.0° |
