K0V
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O1 | C1 | doub | 1.21Å | 1.22Å | |
| C1 | O | sing | 1.34Å | 1.36Å | |
| C1 | C2 | sing | 1.51Å | 1.53Å | |
| C6 | C5 | sing | 1.53Å | 1.53Å | |
| C6 | C2 | sing | 1.54Å | 1.53Å | |
| C | O | sing | 1.45Å | 1.43Å | |
| C5 | N | sing | 1.47Å | 1.50Å | |
| C2 | C3 | sing | 1.53Å | 1.53Å | |
| C11 | C8 | sing | 1.53Å | 1.54Å | |
| N1 | C8 | sing | 1.47Å | 1.50Å | |
| N1 | C7 | sing | 1.35Å | 1.41Å | |
| N | C7 | sing | 1.35Å | 1.49Å | |
| N | C4 | sing | 1.47Å | 1.50Å | |
| C3 | C4 | sing | 1.53Å | 1.54Å | |
| C8 | C10 | sing | 1.53Å | 1.55Å | |
| C8 | C9 | sing | 1.53Å | 1.55Å | |
| C7 | O2 | doub | 1.22Å | 1.24Å | |
| N1 | H1 | sing | 0.97Å | 1.00Å | |
| C4 | H2 | sing | 1.09Å | 1.10Å | |
| C4 | H3 | sing | 1.09Å | 1.10Å | |
| C5 | H4 | sing | 1.09Å | 1.10Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| C6 | H6 | sing | 1.09Å | 1.10Å | |
| C6 | H7 | sing | 1.09Å | 1.10Å | |
| C10 | H8 | sing | 1.09Å | 1.10Å | |
| C10 | H9 | sing | 1.09Å | 1.10Å | |
| C10 | H10 | sing | 1.09Å | 1.10Å | |
| C | H11 | sing | 1.09Å | 1.10Å | |
| C | H12 | sing | 1.09Å | 1.10Å | |
| C | H13 | sing | 1.09Å | 1.10Å | |
| C11 | H14 | sing | 1.09Å | 1.10Å | |
| C11 | H15 | sing | 1.09Å | 1.10Å | |
| C11 | H16 | sing | 1.09Å | 1.10Å | |
| C2 | H17 | sing | 1.09Å | 1.10Å | |
| C3 | H18 | sing | 1.09Å | 1.10Å | |
| C3 | H19 | sing | 1.09Å | 1.10Å | |
| C9 | H20 | sing | 1.09Å | 1.10Å | |
| C9 | H21 | sing | 1.09Å | 1.10Å | |
| C9 | H22 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O1 | C1 | O | 120.2° | 120.0° |
| O1 | C1 | C2 | 125.7° | 120.0° |
| O | C1 | C2 | 114.1° | 120.0° |
| C1 | O | C | 120.3° | 117.0° |
| C1 | C2 | C6 | 110.8° | 109.5° |
| C1 | C2 | C3 | 114.4° | 109.6° |
| C1 | C2 | H17 | 106.9° | 109.5° |
| C5 | C6 | C2 | 109.7° | 109.4° |
| C6 | C5 | N | 112.3° | 108.8° |
| C6 | C5 | H4 | 108.8° | 109.6° |
| C6 | C5 | H5 | 108.8° | 109.8° |
| C5 | C6 | H6 | 109.4° | 109.5° |
| C5 | C6 | H7 | 109.4° | 109.5° |
| C6 | C2 | C3 | 110.4° | 109.4° |
| C2 | C6 | H6 | 109.4° | 109.4° |
| C2 | C6 | H7 | 109.4° | 109.5° |
| C6 | C2 | H17 | 107.0° | 109.5° |
| O | C | H11 | 109.5° | 109.5° |
| O | C | H12 | 109.5° | 109.5° |
| O | C | H13 | 109.5° | 109.5° |
| C5 | N | C7 | 124.6° | 120.6° |
| C5 | N | C4 | 113.7° | 118.7° |
| N | C5 | H4 | 108.8° | 109.6° |
| N | C5 | H5 | 108.7° | 109.5° |
| C2 | C3 | C4 | 107.6° | 109.3° |
| C3 | C2 | H17 | 106.9° | 109.4° |
| C2 | C3 | H18 | 109.9° | 109.5° |
| C2 | C3 | H19 | 109.9° | 109.5° |
| C11 | C8 | N1 | 112.0° | 109.5° |
| C11 | C8 | C10 | 108.2° | 109.5° |
| C11 | C8 | C9 | 108.0° | 109.5° |
| C8 | C11 | H14 | 109.5° | 109.4° |
| C8 | C11 | H15 | 109.5° | 109.5° |
| C8 | C11 | H16 | 109.4° | 109.5° |
| C8 | N1 | C7 | 123.2° | 120.0° |
| N1 | C8 | C10 | 109.8° | 109.5° |
| N1 | C8 | C9 | 106.0° | 109.5° |
| C8 | N1 | H1 | 118.4° | 120.0° |
| N1 | C7 | N | 119.2° | 120.0° |
| N1 | C7 | O2 | 122.1° | 120.0° |
| C7 | N1 | H1 | 118.4° | 120.0° |
| C7 | N | C4 | 118.3° | 120.7° |
| N | C7 | O2 | 118.8° | 120.0° |
| N | C4 | C3 | 113.7° | 108.9° |
| N | C4 | H2 | 108.4° | 109.6° |
| N | C4 | H3 | 108.4° | 109.5° |
| C3 | C4 | H2 | 108.4° | 109.6° |
| C3 | C4 | H3 | 108.4° | 109.6° |
| C4 | C3 | H18 | 109.9° | 109.4° |
| C4 | C3 | H19 | 109.9° | 109.5° |
| C10 | C8 | C9 | 112.8° | 109.4° |
| C8 | C10 | H8 | 109.5° | 109.4° |
| C8 | C10 | H9 | 109.5° | 109.4° |
| C8 | C10 | H10 | 109.5° | 109.5° |
| C8 | C9 | H20 | 109.5° | 109.5° |
| C8 | C9 | H21 | 109.5° | 109.5° |
| C8 | C9 | H22 | 109.5° | 109.5° |
| H2 | C4 | H3 | 109.5° | 109.6° |
| H4 | C5 | H5 | 109.4° | 109.6° |
| H6 | C6 | H7 | 109.5° | 109.5° |
| H8 | C10 | H9 | 109.5° | 109.5° |
| H8 | C10 | H10 | 109.4° | 109.5° |
| H9 | C10 | H10 | 109.5° | 109.5° |
| H11 | C | H12 | 109.5° | 109.5° |
| H11 | C | H13 | 109.4° | 109.5° |
| H12 | C | H13 | 109.4° | 109.5° |
| H14 | C11 | H15 | 109.5° | 109.5° |
| H14 | C11 | H16 | 109.4° | 109.4° |
| H15 | C11 | H16 | 109.5° | 109.5° |
| H18 | C3 | H19 | 109.5° | 109.5° |
| H20 | C9 | H21 | 109.5° | 109.5° |
| H20 | C9 | H22 | 109.4° | 109.5° |
| H21 | C9 | H22 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O1 | C1 | O | C2 | 178.7° | 179.9° |
| O1 | C1 | C2 | C6 | 26.8° | 0.0° |
| O1 | C1 | O | C | 1.0° | 0.0° |
| O1 | C1 | C2 | C3 | 152.4° | 120.1° |
| O1 | C1 | C2 | H17 | 89.4° | 120.0° |
| O | C1 | C2 | C6 | 154.6° | 180.0° |
| O | C1 | C2 | C3 | 29.0° | 60.0° |
| C1 | O | C | H11 | 180.0° | 60.1° |
| C1 | O | C | H12 | 60.0° | 180.0° |
| C1 | O | C | H13 | 60.0° | 60.0° |
| O | C1 | C2 | H17 | 89.2° | 60.0° |
| C1 | C2 | C6 | C5 | 171.1° | 178.6° |
| C1 | C2 | C6 | C3 | 127.8° | 120.1° |
| C1 | C2 | C6 | H17 | 116.2° | 120.0° |
| C2 | C1 | O | C | 179.7° | 180.0° |
| C1 | C2 | C3 | H17 | 118.2° | 120.0° |
| C1 | C2 | C3 | C4 | 173.6° | 178.7° |
| C1 | C2 | C6 | H6 | 68.8° | 61.4° |
| C1 | C2 | C6 | H7 | 51.1° | 58.6° |
| C1 | C2 | C3 | H18 | 66.7° | 58.8° |
| C1 | C2 | C3 | H19 | 53.9° | 61.3° |
| C5 | C6 | C2 | H6 | 120.0° | 120.0° |
| C5 | C6 | C2 | H7 | 120.0° | 120.0° |
| C6 | C5 | N | H4 | 120.4° | 119.8° |
| C6 | C5 | N | H5 | 120.5° | 120.0° |
| C5 | C6 | C2 | C3 | 61.0° | 61.3° |
| C6 | C5 | N | C7 | 109.7° | 126.3° |
| C6 | C5 | N | C4 | 48.9° | 53.6° |
| C6 | C5 | H4 | H5 | 118.7° | 120.5° |
| C5 | C6 | H6 | H7 | 119.9° | 120.1° |
| C5 | C6 | C2 | H17 | 54.9° | 58.6° |
| C2 | C6 | C5 | N | 54.0° | 54.6° |
| C6 | C2 | C3 | H17 | 116.0° | 119.9° |
| C6 | C2 | C3 | C4 | 60.6° | 61.3° |
| C2 | C6 | C5 | H4 | 66.5° | 65.2° |
| C2 | C6 | C5 | H5 | 174.4° | 174.4° |
| C2 | C6 | H6 | H7 | 119.9° | 120.0° |
| C6 | C2 | C3 | H18 | 59.1° | 178.9° |
| C6 | C2 | C3 | H19 | 179.7° | 58.7° |
| O | C | H11 | H12 | 120.0° | 120.0° |
| O | C | H11 | H13 | 120.0° | 120.0° |
| O | C | H12 | H13 | 120.0° | 120.0° |
| C5 | N | C7 | N1 | 11.7° | 174.8° |
| C5 | N | C7 | C4 | 157.7° | 179.9° |
| C5 | N | C4 | C3 | 50.3° | 53.7° |
| C5 | N | C7 | O2 | 169.2° | 5.2° |
| C5 | N | C4 | H2 | 70.3° | 66.2° |
| C5 | N | C4 | H3 | 171.0° | 173.5° |
| N | C5 | H4 | H5 | 118.7° | 120.2° |
| N | C5 | C6 | H6 | 66.1° | 65.3° |
| N | C5 | C6 | H7 | 174.0° | 174.6° |
| C2 | C3 | C4 | N | 55.1° | 54.8° |
| C2 | C3 | C4 | H18 | 119.7° | 119.9° |
| C2 | C3 | C4 | H19 | 119.7° | 120.0° |
| C2 | C3 | C4 | H2 | 65.6° | 65.1° |
| C2 | C3 | C4 | H3 | 175.7° | 174.6° |
| C3 | C2 | C6 | H6 | 59.0° | 58.7° |
| C3 | C2 | C6 | H7 | 178.9° | 178.7° |
| C2 | C3 | H18 | H19 | 120.9° | 120.1° |
| C11 | C8 | N1 | C10 | 120.2° | 120.0° |
| C11 | C8 | N1 | C9 | 117.6° | 120.0° |
| C11 | C8 | N1 | C7 | 178.5° | 180.0° |
| C11 | C8 | C10 | C9 | 119.4° | 120.0° |
| C11 | C8 | N1 | H1 | 1.5° | 0.2° |
| C11 | C8 | C10 | H8 | 180.0° | 60.0° |
| C11 | C8 | C10 | H9 | 60.0° | 60.0° |
| C11 | C8 | C10 | H10 | 60.0° | 180.0° |
| C8 | C11 | H14 | H15 | 120.0° | 120.0° |
| C8 | C11 | H14 | H16 | 120.0° | 120.0° |
| C8 | C11 | H15 | H16 | 120.0° | 120.1° |
| C11 | C8 | C9 | H20 | 180.0° | 180.0° |
| C11 | C8 | C9 | H21 | 60.0° | 59.9° |
| C11 | C8 | C9 | H22 | 60.0° | 60.0° |
| C8 | N1 | C7 | H1 | 180.0° | 179.8° |
| C8 | N1 | C7 | N | 163.2° | 175.0° |
| N1 | C8 | C10 | C9 | 118.0° | 120.0° |
| C8 | N1 | C7 | O2 | 16.0° | 4.9° |
| N1 | C8 | C10 | H8 | 57.4° | 60.0° |
| N1 | C8 | C10 | H9 | 177.4° | 180.0° |
| N1 | C8 | C10 | H10 | 62.5° | 60.0° |
| N1 | C8 | C11 | H14 | 180.0° | 60.0° |
| N1 | C8 | C11 | H15 | 60.0° | 180.0° |
| N1 | C8 | C11 | H16 | 60.0° | 59.9° |
| N1 | C8 | C9 | H20 | 59.8° | 60.0° |
| N1 | C8 | C9 | H21 | 60.3° | 180.0° |
| N1 | C8 | C9 | H22 | 179.7° | 60.0° |
| N1 | C7 | N | O2 | 179.1° | 179.9° |
| N1 | C7 | N | C4 | 169.4° | 5.3° |
| C7 | N1 | C8 | C10 | 58.2° | 60.0° |
| C7 | N1 | C8 | C9 | 64.0° | 60.0° |
| C7 | N | C4 | C3 | 109.7° | 126.2° |
| N | C7 | N1 | H1 | 16.8° | 5.2° |
| C7 | N | C4 | H2 | 129.7° | 113.9° |
| C7 | N | C4 | H3 | 10.9° | 6.4° |
| C7 | N | C5 | H4 | 129.9° | 113.8° |
| C7 | N | C5 | H5 | 10.8° | 6.4° |
| N | C4 | C3 | H2 | 120.6° | 119.9° |
| N | C4 | C3 | H3 | 120.6° | 119.8° |
| C4 | N | C7 | O2 | 11.5° | 174.8° |
| N | C4 | H2 | H3 | 118.1° | 120.2° |
| C4 | N | C5 | H4 | 71.6° | 66.2° |
| C4 | N | C5 | H5 | 169.4° | 173.6° |
| N | C4 | C3 | H18 | 64.6° | 174.7° |
| N | C4 | C3 | H19 | 174.8° | 65.2° |
| C3 | C4 | H2 | H3 | 118.0° | 120.3° |
| C4 | C3 | C2 | H17 | 55.4° | 58.7° |
| C4 | C3 | H18 | H19 | 120.9° | 120.1° |
| C10 | C8 | N1 | H1 | 121.8° | 119.8° |
| C8 | C10 | H8 | H9 | 120.0° | 120.0° |
| C8 | C10 | H8 | H10 | 120.0° | 120.0° |
| C8 | C10 | H9 | H10 | 120.0° | 120.0° |
| C10 | C8 | C11 | H14 | 58.8° | 180.0° |
| C10 | C8 | C11 | H15 | 178.8° | 60.0° |
| C10 | C8 | C11 | H16 | 61.2° | 60.1° |
| C10 | C8 | C9 | H20 | 60.5° | 60.0° |
| C10 | C8 | C9 | H21 | 179.5° | 60.1° |
| C10 | C8 | C9 | H22 | 59.5° | 180.0° |
| C9 | C8 | N1 | H1 | 116.0° | 120.3° |
| C9 | C8 | C10 | H8 | 60.6° | 180.0° |
| C9 | C8 | C10 | H9 | 59.4° | 60.0° |
| C9 | C8 | C10 | H10 | 179.4° | 60.0° |
| C9 | C8 | C11 | H14 | 63.6° | 60.1° |
| C9 | C8 | C11 | H15 | 56.4° | 59.9° |
| C9 | C8 | C11 | H16 | 176.4° | 180.0° |
| C8 | C9 | H20 | H21 | 120.0° | 120.1° |
| C8 | C9 | H20 | H22 | 120.0° | 120.0° |
| C8 | C9 | H21 | H22 | 120.0° | 120.0° |
| O2 | C7 | N1 | H1 | 164.1° | 174.9° |
| H2 | C4 | C3 | H18 | 174.7° | 54.8° |
| H2 | C4 | C3 | H19 | 54.2° | 174.9° |
| H3 | C4 | C3 | H18 | 56.0° | 65.5° |
| H3 | C4 | C3 | H19 | 64.6° | 54.6° |
| H4 | C5 | C6 | H6 | 173.5° | 174.9° |
| H4 | C5 | C6 | H7 | 53.5° | 54.8° |
| H5 | C5 | C6 | H6 | 54.4° | 54.5° |
| H5 | C5 | C6 | H7 | 65.6° | 65.6° |
| H6 | C6 | C2 | H17 | 175.0° | 178.6° |
| H7 | C6 | C2 | H17 | 65.1° | 61.4° |
| H8 | C10 | H9 | H10 | 119.9° | 120.1° |
| H11 | C | H12 | H13 | 120.0° | 120.0° |
| H14 | C11 | H15 | H16 | 120.0° | 119.9° |
| H17 | C2 | C3 | H18 | 175.1° | 61.2° |
| H17 | C2 | C3 | H19 | 64.3° | 178.7° |
| H20 | C9 | H21 | H22 | 120.0° | 120.0° |
