1TI
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C26 | C25 | sing | 1.53Å | 1.47Å | |
C26 | C23 | sing | 1.53Å | 1.41Å | |
C25 | C23 | sing | 1.53Å | 1.44Å | |
C24 | C23 | sing | 1.53Å | 1.51Å | |
C23 | C20 | sing | 1.53Å | 1.55Å | |
C20 | C19 | sing | 1.55Å | 1.54Å | |
C20 | C21 | sing | 1.47Å | 1.45Å | |
C20 | C22 | sing | 1.51Å | 1.49Å | |
C19 | C18 | sing | 1.54Å | 1.51Å | |
C21 | N5 | trip | 1.14Å | 1.12Å | |
C18 | N4 | sing | 1.47Å | 1.47Å | |
C22 | N4 | sing | 1.34Å | 1.36Å | |
C22 | O1 | doub | 1.21Å | 1.19Å | |
N4 | C3 | sing | 1.40Å | 1.41Å | |
C3 | C4 | doub | 1.39Å | 1.37Å | Aromatic |
C3 | C2 | sing | 1.39Å | 1.37Å | Aromatic |
C4 | C5 | sing | 1.39Å | 1.37Å | Aromatic |
O | C6 | doub | 1.22Å | 1.21Å | |
C2 | C1 | doub | 1.38Å | 1.38Å | Aromatic |
C5 | C6 | sing | 1.48Å | 1.50Å | |
C5 | N | doub | 1.33Å | 1.33Å | Aromatic |
C6 | N1 | sing | 1.35Å | 1.33Å | |
N1 | C7 | sing | 1.47Å | 1.46Å | |
C7 | C8 | sing | 1.51Å | 1.51Å | |
C1 | N | sing | 1.32Å | 1.34Å | Aromatic |
C1 | C | sing | 1.51Å | 1.48Å | |
C8 | C13 | doub | 1.38Å | 1.39Å | Aromatic |
C8 | C9 | sing | 1.38Å | 1.38Å | Aromatic |
C13 | C12 | sing | 1.39Å | 1.39Å | Aromatic |
C9 | C10 | doub | 1.39Å | 1.37Å | Aromatic |
C17 | C14 | doub | 1.36Å | 1.36Å | Aromatic |
C17 | N3 | sing | 1.35Å | 1.33Å | Aromatic |
C12 | C14 | sing | 1.48Å | 1.46Å | |
C12 | C11 | doub | 1.39Å | 1.38Å | Aromatic |
C10 | C11 | sing | 1.38Å | 1.35Å | Aromatic |
C10 | F | sing | 1.35Å | 1.32Å | |
C16 | N3 | sing | 1.46Å | 1.45Å | |
C14 | C15 | sing | 1.41Å | 1.39Å | Aromatic |
N3 | N2 | sing | 1.40Å | 1.34Å | Aromatic |
C15 | N2 | doub | 1.31Å | 1.31Å | Aromatic |
C | H1 | sing | 1.09Å | 1.10Å | |
C | H2 | sing | 1.09Å | 1.10Å | |
C | H3 | sing | 1.09Å | 1.10Å | |
C11 | H4 | sing | 1.08Å | 1.08Å | |
C13 | H5 | sing | 1.08Å | 1.08Å | |
C15 | H6 | sing | 1.08Å | 1.08Å | |
C16 | H7 | sing | 1.09Å | 1.10Å | |
C16 | H8 | sing | 1.09Å | 1.10Å | |
C16 | H9 | sing | 1.09Å | 1.10Å | |
C17 | H10 | sing | 1.08Å | 1.08Å | |
C18 | H11 | sing | 1.09Å | 1.10Å | |
C18 | H12 | sing | 1.09Å | 1.10Å | |
C19 | H13 | sing | 1.09Å | 1.10Å | |
C19 | H14 | sing | 1.09Å | 1.10Å | |
C2 | H15 | sing | 1.08Å | 1.08Å | |
C24 | H16 | sing | 1.09Å | 1.10Å | |
C24 | H17 | sing | 1.09Å | 1.10Å | |
C24 | H18 | sing | 1.09Å | 1.10Å | |
C25 | H19 | sing | 1.09Å | 1.10Å | |
C25 | H20 | sing | 1.09Å | 1.10Å | |
C26 | H21 | sing | 1.09Å | 1.10Å | |
C26 | H22 | sing | 1.09Å | 1.10Å | |
C4 | H23 | sing | 1.08Å | 1.08Å | |
C7 | H24 | sing | 1.09Å | 1.10Å | |
C7 | H25 | sing | 1.09Å | 1.10Å | |
C9 | H26 | sing | 1.08Å | 1.08Å | |
N1 | H27 | sing | 0.97Å | 1.00Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C25 | C26 | C23 | 60.1° | 60.0° |
C26 | C25 | C23 | 57.9° | 60.0° |
C26 | C25 | H19 | 120.3° | 117.5° |
C26 | C25 | H20 | 120.3° | 117.5° |
C25 | C26 | H21 | 120.0° | 117.5° |
C25 | C26 | H22 | 120.0° | 117.5° |
C26 | C23 | C25 | 62.0° | 60.0° |
C26 | C23 | C24 | 116.5° | 117.5° |
C26 | C23 | C20 | 118.9° | 117.5° |
C23 | C26 | H21 | 120.0° | 117.5° |
C23 | C26 | H22 | 120.0° | 117.5° |
C25 | C23 | C24 | 118.3° | 117.5° |
C25 | C23 | C20 | 116.9° | 117.5° |
C23 | C25 | H19 | 120.3° | 117.5° |
C23 | C25 | H20 | 120.3° | 117.4° |
C24 | C23 | C20 | 114.4° | 115.6° |
C23 | C24 | H16 | 109.5° | 109.5° |
C23 | C24 | H17 | 109.5° | 109.4° |
C23 | C24 | H18 | 109.5° | 109.4° |
C23 | C20 | C19 | 114.5° | 110.5° |
C23 | C20 | C21 | 112.3° | 110.4° |
C23 | C20 | C22 | 107.3° | 110.6° |
C19 | C20 | C21 | 109.6° | 110.5° |
C19 | C20 | C22 | 103.4° | 104.2° |
C20 | C19 | C18 | 103.4° | 101.8° |
C20 | C19 | H13 | 111.0° | 111.0° |
C20 | C19 | H14 | 111.0° | 111.0° |
C21 | C20 | C22 | 109.2° | 110.5° |
C20 | C21 | N5 | 176.9° | 180.0° |
C20 | C22 | N4 | 108.2° | 110.1° |
C20 | C22 | O1 | 126.4° | 124.9° |
C19 | C18 | N4 | 103.5° | 105.4° |
C19 | C18 | H11 | 110.9° | 110.3° |
C19 | C18 | H12 | 111.0° | 110.4° |
C18 | C19 | H13 | 111.0° | 110.9° |
C18 | C19 | H14 | 111.0° | 111.0° |
C18 | N4 | C22 | 112.8° | 111.3° |
C18 | N4 | C3 | 117.4° | 124.3° |
N4 | C18 | H11 | 110.9° | 110.2° |
N4 | C18 | H12 | 110.9° | 110.3° |
N4 | C22 | O1 | 125.4° | 124.9° |
C22 | N4 | C3 | 129.4° | 124.4° |
N4 | C3 | C4 | 118.7° | 120.8° |
N4 | C3 | C2 | 122.1° | 120.8° |
C4 | C3 | C2 | 119.0° | 118.3° |
C3 | C4 | C5 | 118.6° | 119.0° |
C3 | C4 | H23 | 120.7° | 120.5° |
C3 | C2 | C1 | 119.1° | 119.3° |
C3 | C2 | H15 | 120.4° | 120.4° |
C4 | C5 | C6 | 118.5° | 119.7° |
C4 | C5 | N | 123.3° | 120.6° |
C5 | C4 | H23 | 120.7° | 120.5° |
O | C6 | C5 | 120.7° | 120.0° |
O | C6 | N1 | 122.8° | 120.0° |
C2 | C1 | N | 122.1° | 121.0° |
C2 | C1 | C | 121.5° | 119.5° |
C1 | C2 | H15 | 120.4° | 120.3° |
C6 | C5 | N | 118.2° | 119.7° |
C5 | C6 | N1 | 116.5° | 120.0° |
C5 | N | C1 | 117.9° | 121.8° |
C6 | N1 | C7 | 121.9° | 120.0° |
C6 | N1 | H27 | 119.1° | 120.0° |
N1 | C7 | C8 | 114.0° | 109.4° |
N1 | C7 | H24 | 108.3° | 109.4° |
N1 | C7 | H25 | 108.3° | 109.4° |
C7 | N1 | H27 | 119.1° | 120.0° |
C7 | C8 | C13 | 120.8° | 120.0° |
C7 | C8 | C9 | 120.0° | 119.9° |
C8 | C7 | H24 | 108.3° | 109.6° |
C8 | C7 | H25 | 108.3° | 109.5° |
N | C1 | C | 116.4° | 119.5° |
C1 | C | H1 | 109.5° | 109.5° |
C1 | C | H2 | 109.5° | 109.5° |
C1 | C | H3 | 109.5° | 109.5° |
C13 | C8 | C9 | 119.1° | 120.1° |
C8 | C13 | C12 | 120.6° | 120.0° |
C8 | C13 | H5 | 119.7° | 120.0° |
C8 | C9 | C10 | 118.7° | 120.2° |
C8 | C9 | H26 | 120.6° | 119.9° |
C13 | C12 | C14 | 120.7° | 120.1° |
C13 | C12 | C11 | 119.7° | 119.8° |
C12 | C13 | H5 | 119.7° | 120.0° |
C9 | C10 | C11 | 123.6° | 120.0° |
C9 | C10 | F | 118.6° | 120.0° |
C10 | C9 | H26 | 120.7° | 119.9° |
C14 | C17 | N3 | 106.9° | 107.6° |
C17 | C14 | C12 | 127.7° | 126.2° |
C17 | C14 | C15 | 104.3° | 107.5° |
C14 | C17 | H10 | 126.5° | 126.2° |
C17 | N3 | C16 | 127.6° | 125.9° |
C17 | N3 | N2 | 112.2° | 108.2° |
N3 | C17 | H10 | 126.5° | 126.2° |
C14 | C12 | C11 | 119.6° | 120.1° |
C12 | C14 | C15 | 128.0° | 126.2° |
C12 | C11 | C10 | 118.2° | 119.9° |
C12 | C11 | H4 | 120.9° | 120.1° |
C11 | C10 | F | 117.8° | 120.0° |
C10 | C11 | H4 | 120.9° | 120.0° |
C16 | N3 | N2 | 120.1° | 125.9° |
N3 | C16 | H7 | 109.5° | 109.5° |
N3 | C16 | H8 | 109.5° | 109.5° |
N3 | C16 | H9 | 109.5° | 109.5° |
C14 | C15 | N2 | 112.2° | 108.1° |
C14 | C15 | H6 | 123.9° | 126.0° |
N3 | N2 | C15 | 104.4° | 108.6° |
N2 | C15 | H6 | 123.9° | 125.9° |
H1 | C | H2 | 109.4° | 109.4° |
H1 | C | H3 | 109.4° | 109.5° |
H2 | C | H3 | 109.5° | 109.4° |
H7 | C16 | H8 | 109.4° | 109.5° |
H7 | C16 | H9 | 109.4° | 109.4° |
H8 | C16 | H9 | 109.5° | 109.4° |
H11 | C18 | H12 | 109.5° | 110.2° |
H13 | C19 | H14 | 109.4° | 110.8° |
H16 | C24 | H17 | 109.5° | 109.5° |
H16 | C24 | H18 | 109.4° | 109.5° |
H17 | C24 | H18 | 109.5° | 109.5° |
H19 | C25 | H20 | 109.5° | 115.6° |
H21 | C26 | H22 | 109.5° | 115.6° |
H24 | C7 | H25 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C25 | C26 | C23 | H21 | 109.5° | 107.5° |
C25 | C26 | C23 | H22 | 109.5° | 107.5° |
C26 | C25 | C23 | H19 | 108.9° | 107.5° |
C26 | C25 | C23 | H20 | 108.9° | 107.5° |
C26 | C25 | C23 | C24 | 106.7° | 107.5° |
C25 | C26 | C23 | C20 | 107.0° | 107.5° |
C26 | C25 | H19 | H20 | 145.9° | 145.8° |
C25 | C26 | H21 | H22 | 144.7° | 145.7° |
C26 | C23 | C24 | C20 | 145.1° | 145.7° |
C26 | C23 | C20 | C19 | 82.8° | 111.3° |
C26 | C23 | C20 | C21 | 43.1° | 11.3° |
C26 | C23 | C20 | C22 | 163.1° | 133.9° |
C26 | C23 | C24 | H16 | 180.0° | 154.3° |
C26 | C23 | C24 | H17 | 60.0° | 34.3° |
C26 | C23 | C24 | H18 | 60.0° | 85.7° |
C23 | C26 | H21 | H22 | 144.7° | 145.6° |
C25 | C23 | C24 | C20 | 144.0° | 145.7° |
C25 | C23 | C20 | C19 | 154.0° | 179.9° |
C25 | C23 | C20 | C21 | 28.2° | 57.3° |
C25 | C23 | C20 | C22 | 91.9° | 65.3° |
C25 | C23 | C24 | H16 | 109.2° | 85.7° |
C25 | C23 | C24 | H17 | 10.9° | 34.3° |
C25 | C23 | C24 | H18 | 130.9° | 154.3° |
C23 | C25 | H19 | H20 | 145.9° | 145.6° |
C24 | C23 | C20 | C19 | 61.4° | 34.4° |
C24 | C23 | C20 | C21 | 172.7° | 157.0° |
C24 | C23 | C20 | C22 | 52.7° | 80.4° |
C23 | C24 | H16 | H17 | 120.0° | 120.0° |
C23 | C24 | H16 | H18 | 120.0° | 120.0° |
C23 | C24 | H17 | H18 | 120.0° | 119.9° |
C24 | C23 | C25 | H19 | 144.4° | 0.0° |
C24 | C23 | C25 | H20 | 2.2° | 145.0° |
C24 | C23 | C26 | H21 | 0.1° | 145.0° |
C24 | C23 | C26 | H22 | 140.9° | 0.0° |
C23 | C20 | C19 | C21 | 127.3° | 122.5° |
C23 | C20 | C19 | C22 | 116.4° | 118.8° |
C23 | C20 | C21 | C22 | 118.9° | 122.7° |
C23 | C20 | C19 | C18 | 87.4° | 143.6° |
C23 | C20 | C21 | N5 | 103.3° | 92.5° |
C23 | C20 | C22 | N4 | 100.1° | 135.0° |
C23 | C20 | C22 | O1 | 78.3° | 45.1° |
C23 | C20 | C19 | H13 | 31.7° | 98.3° |
C23 | C20 | C19 | H14 | 153.6° | 25.4° |
C20 | C23 | C24 | H16 | 34.9° | 60.0° |
C20 | C23 | C24 | H17 | 154.9° | 180.0° |
C20 | C23 | C24 | H18 | 85.1° | 60.0° |
C20 | C23 | C25 | H19 | 1.2° | 145.0° |
C20 | C23 | C25 | H20 | 141.0° | 0.0° |
C20 | C23 | C26 | H21 | 143.5° | 0.0° |
C20 | C23 | C26 | H22 | 2.5° | 145.0° |
C19 | C20 | C21 | C22 | 112.6° | 114.8° |
C20 | C19 | C18 | H13 | 119.0° | 118.1° |
C20 | C19 | C18 | H14 | 119.0° | 118.2° |
C19 | C20 | C21 | N5 | 128.2° | 144.9° |
C20 | C19 | C18 | N4 | 26.2° | 25.5° |
C19 | C20 | C22 | N4 | 21.3° | 16.3° |
C19 | C20 | C22 | O1 | 160.3° | 163.8° |
C20 | C19 | C18 | H11 | 92.9° | 144.4° |
C20 | C19 | C18 | H12 | 145.2° | 93.6° |
C20 | C19 | H13 | H14 | 122.8° | 123.8° |
C21 | C20 | C19 | C18 | 145.3° | 93.8° |
C21 | C20 | C22 | N4 | 137.9° | 102.4° |
C21 | C20 | C22 | O1 | 43.7° | 77.5° |
C21 | C20 | C19 | H13 | 95.6° | 24.3° |
C21 | C20 | C19 | H14 | 26.3° | 147.9° |
C22 | C20 | C19 | C18 | 29.0° | 24.9° |
C22 | C20 | C21 | N5 | 15.6° | 30.1° |
C20 | C22 | N4 | C18 | 4.7° | 0.4° |
C20 | C22 | N4 | O1 | 178.4° | 179.9° |
C20 | C22 | N4 | C3 | 167.3° | 179.6° |
C22 | C20 | C19 | H13 | 148.0° | 143.0° |
C22 | C20 | C19 | H14 | 90.1° | 93.4° |
C19 | C18 | N4 | H11 | 119.0° | 119.0° |
C19 | C18 | N4 | H12 | 119.1° | 119.1° |
C19 | C18 | N4 | C22 | 14.2° | 17.1° |
C19 | C18 | N4 | C3 | 172.7° | 162.9° |
C19 | C18 | H11 | H12 | 122.8° | 122.1° |
C18 | C19 | H13 | H14 | 122.8° | 123.8° |
C18 | N4 | C22 | C3 | 172.1° | 180.0° |
C18 | N4 | C22 | O1 | 176.8° | 179.5° |
C18 | N4 | C3 | C4 | 2.0° | 0.0° |
C18 | N4 | C3 | C2 | 176.7° | 179.9° |
N4 | C18 | H11 | H12 | 122.7° | 121.9° |
N4 | C18 | C19 | H13 | 145.2° | 143.6° |
N4 | C18 | C19 | H14 | 92.9° | 92.8° |
C22 | N4 | C3 | C4 | 169.7° | 180.0° |
C22 | N4 | C3 | C2 | 5.0° | 0.1° |
C22 | N4 | C18 | H11 | 104.8° | 136.1° |
C22 | N4 | C18 | H12 | 133.3° | 102.1° |
O1 | C22 | N4 | C3 | 11.1° | 0.5° |
N4 | C3 | C4 | C2 | 174.8° | 179.9° |
N4 | C3 | C4 | C5 | 173.3° | 180.0° |
N4 | C3 | C2 | C1 | 172.9° | 180.0° |
C3 | N4 | C18 | H11 | 68.3° | 43.9° |
C3 | N4 | C18 | H12 | 53.7° | 77.9° |
N4 | C3 | C2 | H15 | 7.1° | 0.1° |
N4 | C3 | C4 | H23 | 6.7° | 0.0° |
C3 | C4 | C5 | H23 | 180.0° | 180.0° |
C4 | C3 | C2 | C1 | 1.8° | 0.1° |
C3 | C4 | C5 | C6 | 177.8° | 180.0° |
C3 | C4 | C5 | N | 0.2° | 0.0° |
C4 | C3 | C2 | H15 | 178.2° | 180.0° |
C2 | C3 | C4 | C5 | 1.5° | 0.0° |
C3 | C2 | C1 | H15 | 180.0° | 179.9° |
C3 | C2 | C1 | N | 0.4° | 0.1° |
C3 | C2 | C1 | C | 179.5° | 180.0° |
C2 | C3 | C4 | H23 | 178.5° | 179.9° |
C4 | C5 | C6 | O | 18.4° | 0.1° |
C4 | C5 | C6 | N | 178.1° | 179.9° |
C4 | C5 | C6 | N1 | 161.5° | 180.0° |
C4 | C5 | N | C1 | 1.6° | 0.0° |
O | C6 | C5 | N1 | 179.9° | 179.9° |
O | C6 | C5 | N | 159.7° | 180.0° |
O | C6 | N1 | C7 | 2.6° | 0.0° |
O | C6 | N1 | H27 | 177.4° | 180.0° |
C2 | C1 | N | C5 | 1.3° | 0.0° |
C2 | C1 | N | C | 179.2° | 180.0° |
C2 | C1 | C | H1 | 179.2° | 89.9° |
C2 | C1 | C | H2 | 59.2° | 30.0° |
C2 | C1 | C | H3 | 60.8° | 150.0° |
C5 | C6 | N1 | C7 | 177.3° | 180.0° |
C6 | C5 | N | C1 | 176.4° | 180.0° |
C6 | C5 | C4 | H23 | 2.2° | 0.0° |
C5 | C6 | N1 | H27 | 2.7° | 0.0° |
N | C5 | C6 | N1 | 20.4° | 0.0° |
C5 | N | C1 | C | 177.9° | 180.0° |
N | C5 | C4 | H23 | 179.9° | 180.0° |
C6 | N1 | C7 | H27 | 180.0° | 180.0° |
C6 | N1 | C7 | C8 | 95.7° | 180.0° |
C6 | N1 | C7 | H24 | 143.7° | 60.0° |
C6 | N1 | C7 | H25 | 25.0° | 60.0° |
N1 | C7 | C8 | H24 | 120.6° | 120.0° |
N1 | C7 | C8 | H25 | 120.7° | 119.9° |
N1 | C7 | C8 | C13 | 80.7° | 90.0° |
N1 | C7 | C8 | C9 | 96.0° | 89.8° |
N1 | C7 | H24 | H25 | 118.0° | 120.0° |
C7 | C8 | C13 | C9 | 176.8° | 179.8° |
C7 | C8 | C13 | C12 | 175.8° | 180.0° |
C7 | C8 | C9 | C10 | 175.1° | 179.7° |
C7 | C8 | C13 | H5 | 4.2° | 0.0° |
C8 | C7 | H24 | H25 | 118.0° | 120.1° |
C7 | C8 | C9 | H26 | 4.9° | 0.0° |
C8 | C7 | N1 | H27 | 84.3° | 0.0° |
N | C1 | C | H1 | 0.0° | 90.1° |
N | C1 | C | H2 | 120.0° | 150.0° |
N | C1 | C | H3 | 120.0° | 30.0° |
N | C1 | C2 | H15 | 179.6° | 180.0° |
C1 | C | H1 | H2 | 120.0° | 120.0° |
C1 | C | H1 | H3 | 120.0° | 120.1° |
C1 | C | H2 | H3 | 120.0° | 120.0° |
C | C1 | C2 | H15 | 0.5° | 0.1° |
C8 | C13 | C12 | H5 | 180.0° | 179.9° |
C13 | C8 | C9 | C10 | 1.7° | 0.6° |
C8 | C13 | C12 | C14 | 177.2° | 180.0° |
C8 | C13 | C12 | C11 | 0.9° | 0.0° |
C13 | C8 | C7 | H24 | 158.7° | 150.0° |
C13 | C8 | C7 | H25 | 40.0° | 29.9° |
C13 | C8 | C9 | H26 | 178.3° | 179.7° |
C9 | C8 | C13 | C12 | 1.0° | 0.3° |
C8 | C9 | C10 | H26 | 180.0° | 179.7° |
C8 | C9 | C10 | C11 | 0.6° | 0.6° |
C8 | C9 | C10 | F | 179.1° | 179.7° |
C9 | C8 | C13 | H5 | 179.0° | 179.8° |
C9 | C8 | C7 | H24 | 24.6° | 30.2° |
C9 | C8 | C7 | H25 | 143.3° | 150.3° |
C13 | C12 | C14 | C17 | 2.5° | 179.7° |
C13 | C12 | C14 | C11 | 178.1° | 179.9° |
C13 | C12 | C11 | C10 | 2.0° | 0.1° |
C13 | C12 | C14 | C15 | 175.2° | 0.0° |
C13 | C12 | C11 | H4 | 178.0° | 180.0° |
C9 | C10 | C11 | C12 | 1.3° | 0.2° |
C9 | C10 | C11 | F | 178.5° | 179.7° |
C9 | C10 | C11 | H4 | 178.7° | 179.7° |
C14 | C17 | N3 | H10 | 180.0° | 180.0° |
C17 | C14 | C12 | C15 | 177.8° | 179.7° |
C17 | C14 | C12 | C11 | 175.6° | 0.2° |
C14 | C17 | N3 | C16 | 178.3° | 180.0° |
C14 | C17 | N3 | N2 | 0.5° | 0.2° |
C17 | C14 | C15 | N2 | 0.1° | 0.2° |
C17 | C14 | C15 | H6 | 179.9° | 179.7° |
N3 | C17 | C14 | C12 | 178.4° | 180.0° |
C17 | N3 | C16 | N2 | 178.7° | 179.8° |
N3 | C17 | C14 | C15 | 0.2° | 0.2° |
C17 | N3 | N2 | C15 | 0.5° | 0.0° |
C17 | N3 | C16 | H7 | 178.7° | 89.9° |
C17 | N3 | C16 | H8 | 58.7° | 150.0° |
C17 | N3 | C16 | H9 | 61.3° | 30.0° |
C14 | C12 | C11 | C10 | 176.1° | 180.0° |
C12 | C14 | C15 | N2 | 178.0° | 180.0° |
C14 | C12 | C11 | H4 | 3.9° | 0.1° |
C14 | C12 | C13 | H5 | 2.8° | 0.0° |
C12 | C14 | C15 | H6 | 2.0° | 0.1° |
C12 | C14 | C17 | H10 | 1.7° | 0.1° |
C12 | C11 | C10 | H4 | 180.0° | 179.9° |
C12 | C11 | C10 | F | 177.2° | 180.0° |
C11 | C12 | C14 | C15 | 6.6° | 180.0° |
C11 | C12 | C13 | H5 | 179.1° | 179.9° |
C11 | C10 | C9 | H26 | 179.4° | 179.8° |
F | C10 | C11 | H4 | 2.8° | 0.0° |
F | C10 | C9 | H26 | 0.9° | 0.0° |
C16 | N3 | N2 | C15 | 178.4° | 179.9° |
N3 | C16 | H7 | H8 | 120.0° | 120.1° |
N3 | C16 | H7 | H9 | 120.0° | 120.0° |
N3 | C16 | H8 | H9 | 120.0° | 120.0° |
C16 | N3 | C17 | H10 | 1.6° | 0.1° |
C14 | C15 | N2 | N3 | 0.4° | 0.1° |
C14 | C15 | N2 | H6 | 180.0° | 180.0° |
C15 | C14 | C17 | H10 | 179.8° | 179.7° |
N3 | N2 | C15 | H6 | 179.6° | 179.8° |
N2 | N3 | C16 | H7 | 0.0° | 90.2° |
N2 | N3 | C16 | H8 | 120.0° | 29.9° |
N2 | N3 | C16 | H9 | 120.0° | 149.8° |
N2 | N3 | C17 | H10 | 179.6° | 179.8° |
H1 | C | H2 | H3 | 119.9° | 120.0° |
H7 | C16 | H8 | H9 | 119.9° | 120.0° |
H11 | C18 | C19 | H13 | 26.2° | 97.5° |
H11 | C18 | C19 | H14 | 148.1° | 26.2° |
H12 | C18 | C19 | H13 | 95.8° | 24.5° |
H12 | C18 | C19 | H14 | 26.2° | 148.2° |
H16 | C24 | H17 | H18 | 119.9° | 120.1° |
H19 | C25 | C26 | H21 | 141.6° | 145.1° |
H19 | C25 | C26 | H22 | 0.6° | 0.0° |
H20 | C25 | C26 | H21 | 0.6° | 0.1° |
H20 | C25 | C26 | H22 | 141.6° | 145.1° |
H24 | C7 | N1 | H27 | 36.3° | 120.1° |
H25 | C7 | N1 | H27 | 155.0° | 119.9° |