K10
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N1 | C1 | sing | 1.38Å | 1.33Å | |
| N1 | HN11 | sing | 0.97Å | 1.00Å | |
| N1 | HN12 | sing | 0.97Å | 1.00Å | |
| C1 | N2 | doub | 1.33Å | 1.34Å | Aromatic |
| C1 | C4 | sing | 1.41Å | 1.38Å | Aromatic |
| N2 | C2 | sing | 1.32Å | 1.33Å | Aromatic |
| C2 | N3 | doub | 1.31Å | 1.31Å | Aromatic |
| C2 | H2 | sing | 1.08Å | 1.08Å | |
| N3 | C3 | sing | 1.33Å | 1.35Å | Aromatic |
| C3 | C4 | doub | 1.41Å | 1.39Å | Aromatic |
| C3 | N5 | sing | 1.36Å | 1.32Å | Aromatic |
| C4 | C5 | sing | 1.41Å | 1.39Å | Aromatic |
| C5 | N4 | doub | 1.30Å | 1.32Å | Aromatic |
| C5 | C10 | sing | 1.51Å | 1.53Å | |
| N4 | N5 | sing | 1.40Å | 1.25Å | Aromatic |
| N5 | C6 | sing | 1.47Å | 1.49Å | |
| C6 | C7 | sing | 1.53Å | 1.54Å | |
| C6 | C8 | sing | 1.53Å | 1.53Å | |
| C6 | C9 | sing | 1.53Å | 1.54Å | |
| C7 | H71 | sing | 1.09Å | 1.10Å | |
| C7 | H72 | sing | 1.09Å | 1.10Å | |
| C7 | H73 | sing | 1.09Å | 1.10Å | |
| C8 | H81 | sing | 1.09Å | 1.10Å | |
| C8 | H82 | sing | 1.09Å | 1.10Å | |
| C8 | H83 | sing | 1.09Å | 1.10Å | |
| C9 | H91 | sing | 1.09Å | 1.10Å | |
| C9 | H92 | sing | 1.09Å | 1.10Å | |
| C9 | H93 | sing | 1.09Å | 1.10Å | |
| C10 | C11 | sing | 1.51Å | 1.53Å | |
| C10 | H101 | sing | 1.09Å | 1.10Å | |
| C10 | H102 | sing | 1.09Å | 1.10Å | |
| C11 | C12 | doub | 1.38Å | 1.40Å | Aromatic |
| C11 | C16 | sing | 1.38Å | 1.39Å | Aromatic |
| C12 | C13 | sing | 1.38Å | 1.39Å | Aromatic |
| C12 | H12 | sing | 1.08Å | 1.08Å | |
| C13 | C14 | doub | 1.38Å | 1.39Å | Aromatic |
| C13 | C18 | sing | 1.51Å | 1.53Å | |
| C14 | C15 | sing | 1.38Å | 1.39Å | Aromatic |
| C14 | H14 | sing | 1.08Å | 1.08Å | |
| C15 | C16 | doub | 1.38Å | 1.38Å | Aromatic |
| C15 | H15 | sing | 1.08Å | 1.08Å | |
| C16 | C17 | sing | 1.51Å | 1.53Å | |
| C17 | H171 | sing | 1.09Å | 1.10Å | |
| C17 | H172 | sing | 1.09Å | 1.10Å | |
| C17 | H173 | sing | 1.09Å | 1.10Å | |
| C18 | H181 | sing | 1.09Å | 1.10Å | |
| C18 | H182 | sing | 1.09Å | 1.10Å | |
| C18 | H183 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C1 | N1 | HN11 | 109.5° | 120.0° |
| C1 | N1 | HN12 | 109.5° | 120.0° |
| N1 | C1 | N2 | 120.4° | 120.8° |
| N1 | C1 | C4 | 120.6° | 120.8° |
| HN11 | N1 | HN12 | 109.5° | 119.9° |
| N2 | C1 | C4 | 119.0° | 118.4° |
| C1 | N2 | C2 | 121.3° | 121.2° |
| C1 | C4 | C3 | 118.7° | 118.3° |
| C1 | C4 | C5 | 136.7° | 134.7° |
| N2 | C2 | N3 | 121.4° | 122.7° |
| N2 | C2 | H2 | 119.3° | 118.7° |
| N3 | C2 | H2 | 119.3° | 118.7° |
| C2 | N3 | C3 | 120.5° | 120.7° |
| N3 | C3 | C4 | 119.1° | 118.8° |
| N3 | C3 | N5 | 134.5° | 134.6° |
| C4 | C3 | N5 | 106.4° | 106.5° |
| C3 | C4 | C5 | 104.6° | 107.1° |
| C3 | N5 | N4 | 111.8° | 108.3° |
| C3 | N5 | C6 | 125.1° | 125.9° |
| C4 | C5 | N4 | 106.8° | 108.5° |
| C4 | C5 | C10 | 126.5° | 125.8° |
| N4 | C5 | C10 | 126.7° | 125.8° |
| C5 | N4 | N5 | 110.5° | 109.7° |
| C5 | C10 | C11 | 111.4° | 109.4° |
| C5 | C10 | H101 | 108.9° | 109.5° |
| C5 | C10 | H102 | 108.4° | 109.5° |
| N4 | N5 | C6 | 123.1° | 125.9° |
| N5 | C6 | C7 | 109.1° | 109.5° |
| N5 | C6 | C8 | 109.4° | 109.5° |
| N5 | C6 | C9 | 109.6° | 109.5° |
| C7 | C6 | C8 | 109.5° | 109.5° |
| C7 | C6 | C9 | 110.1° | 109.5° |
| C6 | C7 | H71 | 109.5° | 109.5° |
| C6 | C7 | H72 | 109.5° | 109.5° |
| C6 | C7 | H73 | 109.4° | 109.4° |
| C8 | C6 | C9 | 109.1° | 109.5° |
| C6 | C8 | H81 | 109.5° | 109.5° |
| C6 | C8 | H82 | 109.5° | 109.5° |
| C6 | C8 | H83 | 109.4° | 109.5° |
| C6 | C9 | H91 | 109.5° | 109.5° |
| C6 | C9 | H92 | 109.5° | 109.5° |
| C6 | C9 | H93 | 109.4° | 109.5° |
| H71 | C7 | H72 | 109.4° | 109.5° |
| H71 | C7 | H73 | 109.5° | 109.5° |
| H72 | C7 | H73 | 109.5° | 109.5° |
| H81 | C8 | H82 | 109.5° | 109.5° |
| H81 | C8 | H83 | 109.5° | 109.5° |
| H82 | C8 | H83 | 109.5° | 109.5° |
| H91 | C9 | H92 | 109.5° | 109.5° |
| H91 | C9 | H93 | 109.5° | 109.4° |
| H92 | C9 | H93 | 109.5° | 109.5° |
| C11 | C10 | H101 | 108.9° | 109.5° |
| C11 | C10 | H102 | 108.4° | 109.4° |
| C10 | C11 | C12 | 116.7° | 120.0° |
| C10 | C11 | C16 | 124.8° | 120.0° |
| H101 | C10 | H102 | 110.9° | 109.5° |
| C12 | C11 | C16 | 118.5° | 120.0° |
| C11 | C12 | C13 | 121.2° | 120.0° |
| C11 | C12 | H12 | 119.4° | 120.0° |
| C11 | C16 | C15 | 120.7° | 120.0° |
| C11 | C16 | C17 | 121.1° | 120.0° |
| C13 | C12 | H12 | 119.4° | 120.0° |
| C12 | C13 | C14 | 119.8° | 120.0° |
| C12 | C13 | C18 | 120.4° | 120.0° |
| C14 | C13 | C18 | 119.8° | 120.0° |
| C13 | C14 | C15 | 119.4° | 120.0° |
| C13 | C14 | H14 | 120.3° | 120.0° |
| C13 | C18 | H181 | 109.5° | 109.5° |
| C13 | C18 | H182 | 109.5° | 109.5° |
| C13 | C18 | H183 | 109.5° | 109.5° |
| C15 | C14 | H14 | 120.3° | 120.1° |
| C14 | C15 | C16 | 120.4° | 120.1° |
| C14 | C15 | H15 | 119.8° | 120.0° |
| C16 | C15 | H15 | 119.8° | 120.0° |
| C15 | C16 | C17 | 118.2° | 120.0° |
| C16 | C17 | H171 | 109.5° | 109.4° |
| C16 | C17 | H172 | 109.5° | 109.5° |
| C16 | C17 | H173 | 109.5° | 109.4° |
| H171 | C17 | H172 | 109.5° | 109.5° |
| H171 | C17 | H173 | 109.5° | 109.4° |
| H172 | C17 | H173 | 109.5° | 109.5° |
| H181 | C18 | H182 | 109.5° | 109.5° |
| H181 | C18 | H183 | 109.5° | 109.4° |
| H182 | C18 | H183 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C1 | N1 | HN11 | HN12 | 120.0° | 180.0° |
| N1 | C1 | N2 | C4 | 179.5° | 179.7° |
| N1 | C1 | N2 | C2 | 179.5° | 180.0° |
| N1 | C1 | C4 | C3 | 179.3° | 179.7° |
| N1 | C1 | C4 | C5 | 1.1° | 0.6° |
| HN11 | N1 | C1 | N2 | 133.2° | 6.4° |
| HN11 | N1 | C1 | C4 | 47.3° | 173.9° |
| HN12 | N1 | C1 | N2 | 106.8° | 173.6° |
| HN12 | N1 | C1 | C4 | 72.7° | 6.2° |
| C1 | N2 | C2 | N3 | 0.3° | 0.1° |
| C1 | N2 | C2 | H2 | 179.7° | 179.9° |
| N2 | C1 | C4 | C3 | 0.2° | 0.5° |
| N2 | C1 | C4 | C5 | 179.4° | 179.6° |
| C4 | C1 | N2 | C2 | 0.0° | 0.3° |
| C1 | C4 | C3 | N3 | 0.2° | 0.5° |
| C1 | C4 | C3 | C5 | 179.7° | 179.3° |
| C1 | C4 | C3 | N5 | 180.0° | 179.7° |
| C1 | C4 | C5 | N4 | 179.9° | 179.5° |
| C1 | C4 | C5 | C10 | 2.1° | 0.7° |
| N2 | C2 | N3 | H2 | 180.0° | 180.0° |
| N2 | C2 | N3 | C3 | 0.3° | 0.1° |
| C2 | N3 | C3 | C4 | 0.0° | 0.3° |
| C2 | N3 | C3 | N5 | 179.7° | 180.0° |
| H2 | C2 | N3 | C3 | 179.7° | 180.0° |
| N3 | C3 | C4 | N5 | 179.8° | 179.8° |
| N3 | C3 | C4 | C5 | 179.5° | 179.8° |
| N3 | C3 | N5 | N4 | 179.5° | 180.0° |
| N3 | C3 | N5 | C6 | 0.0° | 0.0° |
| C3 | C4 | C5 | N4 | 0.2° | 0.4° |
| C3 | C4 | C5 | C10 | 177.6° | 179.9° |
| C4 | C3 | N5 | N4 | 0.2° | 0.2° |
| C4 | C3 | N5 | C6 | 179.7° | 179.8° |
| N5 | C3 | C4 | C5 | 0.3° | 0.3° |
| C3 | N5 | N4 | C5 | 0.1° | 0.0° |
| C3 | N5 | N4 | C6 | 179.6° | 180.0° |
| C3 | N5 | C6 | C7 | 66.6° | 180.0° |
| C3 | N5 | C6 | C8 | 173.6° | 60.0° |
| C3 | N5 | C6 | C9 | 54.1° | 60.0° |
| C4 | C5 | N4 | C10 | 177.8° | 179.8° |
| C4 | C5 | N4 | N5 | 0.1° | 0.2° |
| C4 | C5 | C10 | C11 | 175.0° | 93.9° |
| C4 | C5 | C10 | H101 | 55.0° | 26.2° |
| C4 | C5 | C10 | H102 | 65.7° | 146.2° |
| C5 | N4 | N5 | C6 | 179.6° | 180.0° |
| N4 | C5 | C10 | C11 | 7.6° | 85.9° |
| N4 | C5 | C10 | H101 | 127.6° | 154.1° |
| N4 | C5 | C10 | H102 | 111.6° | 34.0° |
| C10 | C5 | N4 | N5 | 177.7° | 180.0° |
| C5 | C10 | C11 | H101 | 120.0° | 120.0° |
| C5 | C10 | C11 | H102 | 119.2° | 119.9° |
| C5 | C10 | H101 | H102 | 119.2° | 120.0° |
| C5 | C10 | C11 | C12 | 83.1° | 99.8° |
| C5 | C10 | C11 | C16 | 97.1° | 80.1° |
| N4 | N5 | C6 | C7 | 113.9° | 0.0° |
| N4 | N5 | C6 | C8 | 5.9° | 120.0° |
| N4 | N5 | C6 | C9 | 125.4° | 120.0° |
| N5 | C6 | C7 | C8 | 119.7° | 120.0° |
| N5 | C6 | C7 | C9 | 120.3° | 120.0° |
| N5 | C6 | C8 | C9 | 119.8° | 120.0° |
| N5 | C6 | C7 | H71 | 101.2° | 60.0° |
| N5 | C6 | C7 | H72 | 138.8° | 180.0° |
| N5 | C6 | C7 | H73 | 18.8° | 60.0° |
| N5 | C6 | C8 | H81 | 52.9° | 60.0° |
| N5 | C6 | C8 | H82 | 172.9° | 180.0° |
| N5 | C6 | C8 | H83 | 67.1° | 60.0° |
| N5 | C6 | C9 | H91 | 120.2° | 60.0° |
| N5 | C6 | C9 | H92 | 119.8° | 180.0° |
| N5 | C6 | C9 | H93 | 0.2° | 60.0° |
| C7 | C6 | C8 | C9 | 120.6° | 120.0° |
| C6 | C7 | H71 | H72 | 120.0° | 120.0° |
| C6 | C7 | H71 | H73 | 120.0° | 120.0° |
| C6 | C7 | H72 | H73 | 120.0° | 120.0° |
| C7 | C6 | C8 | H81 | 172.5° | 180.0° |
| C7 | C6 | C8 | H82 | 67.5° | 60.0° |
| C7 | C6 | C8 | H83 | 52.5° | 60.0° |
| C7 | C6 | C9 | H91 | 0.2° | 60.0° |
| C7 | C6 | C9 | H92 | 120.2° | 60.0° |
| C7 | C6 | C9 | H93 | 119.8° | 180.0° |
| C8 | C6 | C7 | H71 | 18.5° | 60.0° |
| C8 | C6 | C7 | H72 | 101.5° | 60.0° |
| C8 | C6 | C7 | H73 | 138.5° | 180.0° |
| C6 | C8 | H81 | H82 | 120.0° | 120.0° |
| C6 | C8 | H81 | H83 | 120.0° | 120.0° |
| C6 | C8 | H82 | H83 | 120.0° | 120.0° |
| C8 | C6 | C9 | H91 | 120.1° | 180.0° |
| C8 | C6 | C9 | H92 | 0.1° | 60.0° |
| C8 | C6 | C9 | H93 | 119.9° | 60.0° |
| C9 | C6 | C7 | H71 | 138.4° | 180.0° |
| C9 | C6 | C7 | H72 | 18.5° | 60.0° |
| C9 | C6 | C7 | H73 | 101.5° | 60.0° |
| C9 | C6 | C8 | H81 | 66.9° | 60.0° |
| C9 | C6 | C8 | H82 | 53.1° | 60.0° |
| C9 | C6 | C8 | H83 | 173.1° | 180.0° |
| C6 | C9 | H91 | H92 | 120.0° | 120.0° |
| C6 | C9 | H91 | H93 | 120.0° | 120.0° |
| C6 | C9 | H92 | H93 | 120.0° | 120.1° |
| H71 | C7 | H72 | H73 | 120.0° | 120.0° |
| H81 | C8 | H82 | H83 | 120.0° | 120.0° |
| H91 | C9 | H92 | H93 | 120.0° | 120.0° |
| C11 | C10 | H101 | H102 | 119.2° | 120.0° |
| C10 | C11 | C12 | C16 | 179.8° | 179.9° |
| C10 | C11 | C12 | C13 | 179.7° | 179.7° |
| C10 | C11 | C12 | H12 | 0.3° | 0.1° |
| C10 | C11 | C16 | C15 | 179.9° | 180.0° |
| C10 | C11 | C16 | C17 | 0.0° | 0.0° |
| H101 | C10 | C11 | C12 | 156.9° | 20.2° |
| H101 | C10 | C11 | C16 | 22.9° | 159.9° |
| H102 | C10 | C11 | C12 | 36.2° | 140.3° |
| H102 | C10 | C11 | C16 | 143.7° | 39.9° |
| C11 | C12 | C13 | H12 | 180.0° | 179.6° |
| C11 | C12 | C13 | C14 | 0.4° | 0.5° |
| C11 | C12 | C13 | C18 | 179.7° | 179.8° |
| C12 | C11 | C16 | C15 | 0.3° | 0.1° |
| C12 | C11 | C16 | C17 | 179.8° | 179.9° |
| C16 | C11 | C12 | C13 | 0.5° | 0.4° |
| C16 | C11 | C12 | H12 | 179.5° | 180.0° |
| C11 | C16 | C15 | C14 | 0.0° | 0.1° |
| C11 | C16 | C15 | C17 | 179.9° | 180.0° |
| C11 | C16 | C15 | H15 | 180.0° | 180.0° |
| C11 | C16 | C17 | H171 | 109.0° | 92.9° |
| C11 | C16 | C17 | H172 | 131.0° | 27.1° |
| C11 | C16 | C17 | H173 | 11.0° | 147.2° |
| C12 | C13 | C14 | C18 | 179.3° | 179.7° |
| C12 | C13 | C14 | C15 | 0.1° | 0.3° |
| C12 | C13 | C14 | H14 | 179.9° | 179.8° |
| C12 | C13 | C18 | H181 | 71.8° | 90.3° |
| C12 | C13 | C18 | H182 | 168.2° | 29.8° |
| C12 | C13 | C18 | H183 | 48.2° | 149.7° |
| H12 | C12 | C13 | C14 | 179.6° | 179.9° |
| H12 | C12 | C13 | C18 | 0.3° | 0.2° |
| C13 | C14 | C15 | H14 | 180.0° | 179.9° |
| C13 | C14 | C15 | C16 | 0.1° | 0.0° |
| C13 | C14 | C15 | H15 | 179.9° | 179.9° |
| C14 | C13 | C18 | H181 | 108.9° | 90.0° |
| C14 | C13 | C18 | H182 | 11.1° | 150.0° |
| C14 | C13 | C18 | H183 | 131.1° | 30.0° |
| C18 | C13 | C14 | C15 | 179.4° | 180.0° |
| C18 | C13 | C14 | H14 | 0.6° | 0.0° |
| C13 | C18 | H181 | H182 | 120.0° | 120.1° |
| C13 | C18 | H181 | H183 | 120.0° | 120.0° |
| C13 | C18 | H182 | H183 | 120.0° | 120.0° |
| C14 | C15 | C16 | H15 | 180.0° | 179.9° |
| C14 | C15 | C16 | C17 | 179.9° | 180.0° |
| H14 | C14 | C15 | C16 | 179.9° | 180.0° |
| H14 | C14 | C15 | H15 | 0.1° | 0.0° |
| C15 | C16 | C17 | H171 | 71.2° | 87.1° |
| C15 | C16 | C17 | H172 | 48.8° | 152.9° |
| C15 | C16 | C17 | H173 | 168.9° | 32.8° |
| H15 | C15 | C16 | C17 | 0.1° | 0.0° |
| C16 | C17 | H171 | H172 | 120.0° | 120.0° |
| C16 | C17 | H171 | H173 | 120.0° | 119.9° |
| C16 | C17 | H172 | H173 | 120.0° | 120.0° |
| H171 | C17 | H172 | H173 | 120.0° | 120.0° |
| H181 | C18 | H182 | H183 | 120.0° | 120.0° |
