NJI
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C2 | C1 | sing | 1.51Å | 1.49Å | |
C3 | N1 | sing | 1.47Å | 1.47Å | |
C3 | C4 | sing | 1.53Å | 1.55Å | |
C1 | N1 | sing | 1.35Å | 1.32Å | |
C1 | O1 | doub | 1.21Å | 1.22Å | |
N1 | C21 | sing | 1.47Å | 1.46Å | |
C6 | C5 | sing | 1.53Å | 1.49Å | |
C6 | N2 | sing | 1.47Å | 1.47Å | |
C19 | N2 | sing | 1.47Å | 1.47Å | |
C19 | C20 | sing | 1.53Å | 1.48Å | |
C4 | C5 | sing | 1.53Å | 1.53Å | |
C4 | C20 | sing | 1.53Å | 1.53Å | |
C4 | C21 | sing | 1.53Å | 1.54Å | |
N2 | C7 | sing | 1.35Å | 1.33Å | |
C15 | C16 | sing | 1.53Å | 1.51Å | |
C15 | C8 | sing | 1.53Å | 1.54Å | |
C7 | O2 | doub | 1.21Å | 1.23Å | |
C7 | C8 | sing | 1.51Å | 1.53Å | |
C16 | O3 | sing | 1.43Å | 1.43Å | |
C8 | N3 | sing | 1.47Å | 1.45Å | |
C8 | C18 | sing | 1.53Å | 1.54Å | |
O3 | C17 | sing | 1.43Å | 1.43Å | |
N3 | C9 | sing | 1.40Å | 1.39Å | |
C18 | C17 | sing | 1.53Å | 1.50Å | |
C9 | C10 | doub | 1.39Å | 1.40Å | Aromatic |
C9 | C14 | sing | 1.39Å | 1.40Å | Aromatic |
C10 | C11 | sing | 1.38Å | 1.38Å | Aromatic |
C14 | C13 | doub | 1.38Å | 1.38Å | Aromatic |
C11 | C12 | doub | 1.38Å | 1.38Å | Aromatic |
C13 | C12 | sing | 1.38Å | 1.37Å | Aromatic |
C12 | CL2 | sing | 1.74Å | 1.73Å | |
C2 | H1 | sing | 1.09Å | 1.10Å | |
C2 | H2 | sing | 1.09Å | 1.10Å | |
C2 | CL1 | sing | 1.80Å | 1.07Å | |
C3 | H4 | sing | 1.09Å | 1.10Å | |
C3 | H5 | sing | 1.09Å | 1.10Å | |
C5 | H6 | sing | 1.09Å | 1.10Å | |
C5 | H7 | sing | 1.09Å | 1.10Å | |
C6 | H8 | sing | 1.09Å | 1.10Å | |
C6 | H9 | sing | 1.09Å | 1.10Å | |
N3 | H10 | sing | 0.97Å | 1.00Å | |
C10 | H11 | sing | 1.08Å | 1.08Å | |
C11 | H12 | sing | 1.08Å | 1.08Å | |
C13 | H13 | sing | 1.08Å | 1.08Å | |
C14 | H14 | sing | 1.08Å | 1.08Å | |
C15 | H15 | sing | 1.09Å | 1.10Å | |
C15 | H16 | sing | 1.09Å | 1.10Å | |
C16 | H17 | sing | 1.09Å | 1.10Å | |
C16 | H18 | sing | 1.09Å | 1.10Å | |
C17 | H19 | sing | 1.09Å | 1.10Å | |
C17 | H20 | sing | 1.09Å | 1.10Å | |
C18 | H21 | sing | 1.09Å | 1.10Å | |
C18 | H22 | sing | 1.09Å | 1.10Å | |
C19 | H23 | sing | 1.09Å | 1.10Å | |
C19 | H24 | sing | 1.09Å | 1.10Å | |
C20 | H25 | sing | 1.09Å | 1.10Å | |
C20 | H26 | sing | 1.09Å | 1.10Å | |
C21 | H27 | sing | 1.09Å | 1.10Å | |
C21 | H28 | sing | 1.09Å | 1.10Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C2 | C1 | N1 | 112.3° | 120.0° |
C2 | C1 | O1 | 124.6° | 120.0° |
C1 | C2 | H1 | 109.6° | 109.4° |
C1 | C2 | H2 | 109.5° | 109.5° |
C1 | C2 | CL1 | 109.2° | 109.5° |
N1 | C3 | C4 | 86.1° | 87.9° |
C3 | N1 | C1 | 133.9° | 136.0° |
C3 | N1 | C21 | 96.3° | 88.0° |
N1 | C3 | H4 | 115.0° | 113.5° |
N1 | C3 | H5 | 114.9° | 113.5° |
C3 | C4 | C5 | 118.2° | 114.1° |
C3 | C4 | C20 | 114.0° | 114.1° |
C3 | C4 | C21 | 89.8° | 84.0° |
C4 | C3 | H4 | 114.9° | 113.5° |
C4 | C3 | H5 | 114.9° | 113.5° |
N1 | C1 | O1 | 123.0° | 120.0° |
C1 | N1 | C21 | 129.8° | 136.0° |
N1 | C21 | C4 | 87.3° | 88.0° |
N1 | C21 | H27 | 114.7° | 113.5° |
N1 | C21 | H28 | 114.7° | 113.5° |
C5 | C6 | N2 | 108.9° | 108.7° |
C6 | C5 | C4 | 112.6° | 109.1° |
C6 | C5 | H6 | 108.7° | 109.5° |
C6 | C5 | H7 | 108.7° | 109.6° |
C5 | C6 | H8 | 109.6° | 109.6° |
C5 | C6 | H9 | 109.6° | 109.6° |
C6 | N2 | C19 | 113.6° | 119.1° |
C6 | N2 | C7 | 116.9° | 120.4° |
N2 | C6 | H8 | 109.6° | 109.6° |
N2 | C6 | H9 | 109.6° | 109.6° |
N2 | C19 | C20 | 109.0° | 108.8° |
C19 | N2 | C7 | 129.5° | 120.5° |
N2 | C19 | H23 | 109.6° | 109.6° |
N2 | C19 | H24 | 109.6° | 109.6° |
C19 | C20 | C4 | 110.7° | 109.1° |
C20 | C19 | H23 | 109.6° | 109.5° |
C20 | C19 | H24 | 109.6° | 109.6° |
C19 | C20 | H25 | 109.2° | 109.5° |
C19 | C20 | H26 | 109.2° | 109.5° |
C5 | C4 | C20 | 114.2° | 113.4° |
C5 | C4 | C21 | 108.4° | 114.3° |
C4 | C5 | H6 | 108.7° | 109.5° |
C4 | C5 | H7 | 108.7° | 109.5° |
C20 | C4 | C21 | 109.1° | 113.9° |
C4 | C20 | H25 | 109.2° | 109.5° |
C4 | C20 | H26 | 109.2° | 109.5° |
C4 | C21 | H27 | 114.7° | 113.4° |
C4 | C21 | H28 | 114.7° | 113.5° |
N2 | C7 | O2 | 118.6° | 120.0° |
N2 | C7 | C8 | 120.6° | 120.0° |
C16 | C15 | C8 | 110.4° | 109.2° |
C15 | C16 | O3 | 111.6° | 109.4° |
C16 | C15 | H15 | 109.2° | 109.5° |
C16 | C15 | H16 | 109.2° | 109.5° |
C15 | C16 | H17 | 108.9° | 109.5° |
C15 | C16 | H18 | 109.0° | 109.5° |
C15 | C8 | C7 | 108.0° | 109.5° |
C15 | C8 | N3 | 109.6° | 109.5° |
C15 | C8 | C18 | 108.2° | 109.2° |
C8 | C15 | H15 | 109.2° | 109.5° |
C8 | C15 | H16 | 109.2° | 109.5° |
O2 | C7 | C8 | 120.7° | 120.0° |
C7 | C8 | N3 | 112.8° | 109.5° |
C7 | C8 | C18 | 107.1° | 109.5° |
C16 | O3 | C17 | 110.9° | 114.1° |
O3 | C16 | H17 | 108.9° | 109.5° |
O3 | C16 | H18 | 108.9° | 109.4° |
N3 | C8 | C18 | 110.9° | 109.5° |
C8 | N3 | C9 | 125.2° | 120.0° |
C8 | N3 | H10 | 105.4° | 120.0° |
C8 | C18 | C17 | 109.4° | 109.2° |
C8 | C18 | H21 | 109.5° | 109.5° |
C8 | C18 | H22 | 109.5° | 109.5° |
O3 | C17 | C18 | 110.7° | 109.5° |
O3 | C17 | H19 | 109.2° | 109.5° |
O3 | C17 | H20 | 109.2° | 109.4° |
N3 | C9 | C10 | 117.1° | 120.1° |
N3 | C9 | C14 | 123.8° | 120.0° |
C9 | N3 | H10 | 105.4° | 120.0° |
C18 | C17 | H19 | 109.2° | 109.5° |
C18 | C17 | H20 | 109.2° | 109.4° |
C17 | C18 | H21 | 109.5° | 109.6° |
C17 | C18 | H22 | 109.5° | 109.4° |
C10 | C9 | C14 | 118.9° | 119.9° |
C9 | C10 | C11 | 120.2° | 120.0° |
C9 | C10 | H11 | 119.9° | 120.0° |
C9 | C14 | C13 | 120.8° | 119.9° |
C9 | C14 | H14 | 119.6° | 120.0° |
C10 | C11 | C12 | 118.8° | 120.0° |
C11 | C10 | H11 | 119.9° | 120.0° |
C10 | C11 | H12 | 120.6° | 120.0° |
C14 | C13 | C12 | 118.5° | 120.1° |
C14 | C13 | H13 | 120.7° | 119.9° |
C13 | C14 | H14 | 119.6° | 120.1° |
C11 | C12 | C13 | 122.6° | 120.1° |
C11 | C12 | CL2 | 119.0° | 119.9° |
C12 | C11 | H12 | 120.6° | 119.9° |
C13 | C12 | CL2 | 118.4° | 120.0° |
C12 | C13 | H13 | 120.7° | 120.0° |
H1 | C2 | H2 | 109.5° | 109.5° |
H1 | C2 | CL1 | 109.5° | 109.5° |
H2 | C2 | CL1 | 109.5° | 109.5° |
H4 | C3 | H5 | 109.5° | 112.8° |
H6 | C5 | H7 | 109.4° | 109.6° |
H8 | C6 | H9 | 109.5° | 109.7° |
H15 | C15 | H16 | 109.4° | 109.6° |
H17 | C16 | H18 | 109.5° | 109.5° |
H19 | C17 | H20 | 109.4° | 109.5° |
H21 | C18 | H22 | 109.5° | 109.6° |
H23 | C19 | H24 | 109.5° | 109.7° |
H25 | C20 | H26 | 109.5° | 109.7° |
H27 | C21 | H28 | 109.4° | 112.8° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C2 | C1 | N1 | C3 | 12.6° | 4.8° |
C2 | C1 | N1 | O1 | 176.3° | 179.8° |
C2 | C1 | N1 | C21 | 165.2° | 174.8° |
C1 | C2 | H1 | H2 | 120.1° | 120.0° |
C1 | C2 | H1 | CL1 | 119.7° | 120.0° |
C1 | C2 | H2 | CL1 | 119.7° | 120.0° |
N1 | C3 | C4 | H4 | 115.8° | 114.8° |
N1 | C3 | C4 | H5 | 115.7° | 114.8° |
C3 | N1 | C1 | C21 | 177.8° | 179.6° |
C3 | N1 | C1 | O1 | 171.2° | 175.4° |
N1 | C3 | C4 | C5 | 105.7° | 139.4° |
N1 | C3 | C4 | C20 | 116.0° | 87.9° |
N1 | C3 | C4 | C21 | 5.2° | 25.5° |
N1 | C3 | H4 | H5 | 131.2° | 130.8° |
C3 | N1 | C21 | H27 | 110.5° | 141.2° |
C3 | N1 | C21 | H28 | 121.6° | 88.3° |
C4 | C3 | N1 | C1 | 176.2° | 153.3° |
C3 | C4 | C5 | C6 | 92.4° | 75.5° |
C3 | C4 | C20 | C19 | 92.3° | 75.6° |
C3 | C4 | C5 | C20 | 138.2° | 132.9° |
C3 | C4 | C5 | C21 | 100.0° | 94.3° |
C3 | C4 | C20 | C21 | 98.6° | 94.1° |
C4 | C3 | H4 | H5 | 131.2° | 130.8° |
C3 | C4 | C5 | H6 | 28.1° | 164.6° |
C3 | C4 | C5 | H7 | 147.1° | 44.4° |
C3 | C4 | C20 | H25 | 147.5° | 44.3° |
C3 | C4 | C20 | H26 | 27.9° | 164.6° |
C3 | C4 | C21 | H27 | 110.8° | 140.3° |
C3 | C4 | C21 | H28 | 121.2° | 89.3° |
C1 | N1 | C21 | C4 | 176.1° | 153.3° |
N1 | C1 | C2 | H1 | 116.7° | 54.5° |
N1 | C1 | C2 | H2 | 3.4° | 65.5° |
N1 | C1 | C2 | CL1 | 123.3° | 174.4° |
C1 | N1 | C3 | H4 | 60.5° | 91.9° |
C1 | N1 | C3 | H5 | 68.0° | 38.6° |
C1 | N1 | C21 | H27 | 67.9° | 38.6° |
C1 | N1 | C21 | H28 | 60.0° | 91.9° |
O1 | C1 | N1 | C21 | 11.0° | 4.9° |
O1 | C1 | C2 | H1 | 59.4° | 125.3° |
O1 | C1 | C2 | H2 | 179.6° | 114.7° |
O1 | C1 | C2 | CL1 | 60.5° | 5.3° |
N1 | C21 | C4 | C5 | 114.5° | 139.3° |
N1 | C21 | C4 | C20 | 120.6° | 88.2° |
N1 | C21 | C4 | H27 | 116.0° | 114.8° |
N1 | C21 | C4 | H28 | 116.0° | 114.8° |
C21 | N1 | C3 | H4 | 121.2° | 88.4° |
C21 | N1 | C3 | H5 | 110.3° | 141.2° |
N1 | C21 | H27 | H28 | 130.6° | 130.9° |
C5 | C6 | N2 | H8 | 119.9° | 119.7° |
C5 | C6 | N2 | H9 | 119.9° | 119.8° |
C5 | C6 | N2 | C19 | 61.4° | 55.7° |
C6 | C5 | C4 | H6 | 120.5° | 119.9° |
C6 | C5 | C4 | H7 | 120.5° | 119.9° |
C6 | C5 | C4 | C20 | 45.8° | 57.4° |
C6 | C5 | C4 | C21 | 167.6° | 169.8° |
C5 | C6 | N2 | C7 | 120.0° | 124.4° |
C6 | C5 | H6 | H7 | 118.6° | 120.2° |
C5 | C6 | H8 | H9 | 120.3° | 120.4° |
C6 | N2 | C19 | C7 | 178.3° | 179.9° |
C6 | N2 | C19 | C20 | 64.4° | 55.7° |
N2 | C6 | C5 | C4 | 50.4° | 52.3° |
C6 | N2 | C7 | O2 | 0.8° | 5.6° |
C6 | N2 | C7 | C8 | 176.9° | 174.3° |
N2 | C6 | C5 | H6 | 170.8° | 67.6° |
N2 | C6 | C5 | H7 | 70.1° | 172.1° |
N2 | C6 | H8 | H9 | 120.3° | 120.4° |
C6 | N2 | C19 | H23 | 175.7° | 175.4° |
C6 | N2 | C19 | H24 | 55.5° | 64.1° |
N2 | C19 | C20 | H23 | 119.9° | 119.8° |
N2 | C19 | C20 | H24 | 119.9° | 119.8° |
N2 | C19 | C20 | C4 | 54.7° | 52.3° |
C19 | N2 | C7 | O2 | 177.5° | 174.3° |
C19 | N2 | C7 | C8 | 1.4° | 5.8° |
C19 | N2 | C6 | H8 | 178.7° | 175.4° |
C19 | N2 | C6 | H9 | 58.5° | 64.1° |
N2 | C19 | H23 | H24 | 120.3° | 120.4° |
N2 | C19 | C20 | H25 | 65.5° | 172.1° |
N2 | C19 | C20 | H26 | 174.9° | 67.6° |
C19 | C20 | C4 | C5 | 47.7° | 57.4° |
C19 | C20 | C4 | H25 | 120.2° | 119.8° |
C19 | C20 | C4 | H26 | 120.2° | 119.9° |
C19 | C20 | C4 | C21 | 169.1° | 169.7° |
C20 | C19 | N2 | C7 | 117.3° | 124.4° |
C20 | C19 | H23 | H24 | 120.2° | 120.4° |
C19 | C20 | H25 | H26 | 119.4° | 120.2° |
C5 | C4 | C20 | C21 | 121.4° | 133.0° |
C5 | C4 | C3 | H4 | 10.1° | 24.7° |
C5 | C4 | C3 | H5 | 138.6° | 105.8° |
C4 | C5 | H6 | H7 | 118.5° | 120.2° |
C4 | C5 | C6 | H8 | 170.3° | 172.1° |
C4 | C5 | C6 | H9 | 69.6° | 67.5° |
C5 | C4 | C20 | H25 | 72.5° | 177.2° |
C5 | C4 | C20 | H26 | 167.8° | 62.5° |
C5 | C4 | C21 | H27 | 129.4° | 105.9° |
C5 | C4 | C21 | H28 | 1.5° | 24.4° |
C20 | C4 | C3 | H4 | 128.2° | 157.3° |
C20 | C4 | C3 | H5 | 0.3° | 26.8° |
C20 | C4 | C5 | H6 | 166.3° | 62.5° |
C20 | C4 | C5 | H7 | 74.7° | 177.3° |
C4 | C20 | C19 | H23 | 174.6° | 172.0° |
C4 | C20 | C19 | H24 | 65.2° | 67.5° |
C4 | C20 | H25 | H26 | 119.4° | 120.2° |
C20 | C4 | C21 | H27 | 4.6° | 26.6° |
C20 | C4 | C21 | H28 | 123.4° | 157.0° |
C21 | C4 | C3 | H4 | 120.9° | 89.2° |
C21 | C4 | C3 | H5 | 110.6° | 140.3° |
C21 | C4 | C5 | H6 | 71.9° | 70.3° |
C21 | C4 | C5 | H7 | 47.1° | 49.9° |
C21 | C4 | C20 | H25 | 48.9° | 49.8° |
C21 | C4 | C20 | H26 | 70.8° | 70.5° |
C4 | C21 | H27 | H28 | 130.6° | 130.7° |
N2 | C7 | C8 | C15 | 68.9° | 76.2° |
N2 | C7 | O2 | C8 | 176.1° | 179.9° |
N2 | C7 | C8 | N3 | 52.4° | 43.9° |
N2 | C7 | C8 | C18 | 174.7° | 164.1° |
C7 | N2 | C6 | H8 | 0.2° | 4.7° |
C7 | N2 | C6 | H9 | 120.1° | 115.8° |
C7 | N2 | C19 | H23 | 2.6° | 4.7° |
C7 | N2 | C19 | H24 | 122.8° | 115.8° |
C16 | C15 | C8 | H15 | 120.2° | 119.9° |
C16 | C15 | C8 | H16 | 120.1° | 119.9° |
C16 | C15 | C8 | C7 | 168.8° | 176.8° |
C15 | C16 | O3 | H17 | 120.3° | 120.0° |
C15 | C16 | O3 | H18 | 120.3° | 120.0° |
C16 | C15 | C8 | N3 | 67.9° | 63.0° |
C16 | C15 | C8 | C18 | 53.1° | 56.9° |
C15 | C16 | O3 | C17 | 60.7° | 61.1° |
C16 | C15 | H15 | H16 | 119.6° | 120.2° |
C15 | C16 | H17 | H18 | 119.1° | 120.1° |
C15 | C8 | C7 | O2 | 107.0° | 103.8° |
C15 | C8 | C7 | N3 | 121.3° | 120.2° |
C15 | C8 | C7 | C18 | 116.4° | 119.7° |
C8 | C15 | C16 | O3 | 56.2° | 57.6° |
C15 | C8 | N3 | C18 | 119.4° | 119.7° |
C15 | C8 | N3 | C9 | 165.5° | 179.5° |
C15 | C8 | C18 | C17 | 55.1° | 56.8° |
C15 | C8 | N3 | H10 | 72.4° | 0.5° |
C8 | C15 | H15 | H16 | 119.5° | 120.1° |
C8 | C15 | C16 | H17 | 176.6° | 177.5° |
C8 | C15 | C16 | H18 | 64.1° | 62.4° |
C15 | C8 | C18 | H21 | 175.1° | 176.8° |
C15 | C8 | C18 | H22 | 64.9° | 63.0° |
O2 | C7 | C8 | N3 | 131.6° | 136.0° |
O2 | C7 | C8 | C18 | 9.3° | 15.8° |
C7 | C8 | N3 | C18 | 120.2° | 120.2° |
C7 | C8 | N3 | C9 | 45.1° | 60.4° |
C7 | C8 | C18 | C17 | 171.3° | 176.7° |
C7 | C8 | N3 | H10 | 167.2° | 119.7° |
C7 | C8 | C15 | H15 | 71.0° | 57.0° |
C7 | C8 | C15 | H16 | 48.6° | 63.3° |
C7 | C8 | C18 | H21 | 68.7° | 63.3° |
C7 | C8 | C18 | H22 | 51.3° | 56.9° |
C16 | O3 | C17 | C18 | 63.0° | 61.1° |
O3 | C16 | C15 | H15 | 176.4° | 62.3° |
O3 | C16 | C15 | H16 | 63.9° | 177.5° |
O3 | C16 | H17 | H18 | 119.0° | 119.9° |
C16 | O3 | C17 | H19 | 176.8° | 178.8° |
C16 | O3 | C17 | H20 | 57.2° | 58.9° |
C8 | N3 | C9 | H10 | 122.1° | 179.9° |
N3 | C8 | C18 | C17 | 65.1° | 63.1° |
C8 | N3 | C9 | C10 | 170.3° | 173.4° |
C8 | N3 | C9 | C14 | 5.3° | 6.9° |
N3 | C8 | C15 | H15 | 52.3° | 177.1° |
N3 | C8 | C15 | H16 | 171.9° | 56.9° |
N3 | C8 | C18 | H21 | 54.8° | 56.9° |
N3 | C8 | C18 | H22 | 174.9° | 177.1° |
C8 | C18 | C17 | O3 | 60.6° | 57.4° |
C18 | C8 | N3 | C9 | 75.1° | 59.8° |
C8 | C18 | C17 | H21 | 120.0° | 120.0° |
C8 | C18 | C17 | H22 | 120.0° | 119.8° |
C18 | C8 | N3 | H10 | 47.0° | 120.2° |
C18 | C8 | C15 | H15 | 173.3° | 63.0° |
C18 | C8 | C15 | H16 | 67.1° | 176.8° |
C8 | C18 | C17 | H19 | 179.2° | 177.5° |
C8 | C18 | C17 | H20 | 59.6° | 62.5° |
C8 | C18 | H21 | H22 | 120.0° | 120.1° |
O3 | C17 | C18 | H19 | 120.2° | 120.1° |
O3 | C17 | C18 | H20 | 120.2° | 119.9° |
C17 | O3 | C16 | H17 | 179.0° | 178.8° |
C17 | O3 | C16 | H18 | 59.6° | 58.8° |
O3 | C17 | H19 | H20 | 119.5° | 120.0° |
O3 | C17 | C18 | H21 | 179.4° | 177.4° |
O3 | C17 | C18 | H22 | 59.4° | 62.4° |
N3 | C9 | C10 | C14 | 175.8° | 179.7° |
N3 | C9 | C10 | C11 | 178.4° | 180.0° |
N3 | C9 | C14 | C13 | 177.3° | 179.7° |
N3 | C9 | C10 | H11 | 1.7° | 0.0° |
N3 | C9 | C14 | H14 | 2.7° | 0.0° |
C18 | C17 | H19 | H20 | 119.4° | 120.0° |
C17 | C18 | H21 | H22 | 120.0° | 120.1° |
C9 | C10 | C11 | H11 | 180.0° | 180.0° |
C10 | C9 | C14 | C13 | 1.7° | 0.6° |
C9 | C10 | C11 | C12 | 3.1° | 0.0° |
C10 | C9 | N3 | H10 | 67.6° | 6.5° |
C9 | C10 | C11 | H12 | 177.0° | 180.0° |
C10 | C9 | C14 | H14 | 178.2° | 179.7° |
C14 | C9 | C10 | C11 | 2.5° | 0.3° |
C9 | C14 | C13 | H14 | 180.0° | 179.7° |
C9 | C14 | C13 | C12 | 1.5° | 0.5° |
C14 | C9 | N3 | H10 | 116.8° | 173.2° |
C14 | C9 | C10 | H11 | 177.5° | 179.7° |
C9 | C14 | C13 | H13 | 178.5° | 179.7° |
C10 | C11 | C12 | H12 | 180.0° | 180.0° |
C10 | C11 | C12 | C13 | 2.9° | 0.0° |
C10 | C11 | C12 | CL2 | 179.1° | 180.0° |
C14 | C13 | C12 | C11 | 2.1° | 0.2° |
C14 | C13 | C12 | H13 | 180.0° | 179.8° |
C14 | C13 | C12 | CL2 | 179.9° | 179.7° |
C11 | C12 | C13 | CL2 | 178.0° | 179.9° |
C12 | C11 | C10 | H11 | 177.0° | 180.0° |
C11 | C12 | C13 | H13 | 177.9° | 180.0° |
C13 | C12 | C11 | H12 | 177.1° | 180.0° |
C12 | C13 | C14 | H14 | 178.5° | 179.7° |
CL2 | C12 | C11 | H12 | 0.9° | 0.1° |
CL2 | C12 | C13 | H13 | 0.1° | 0.1° |
H1 | C2 | H2 | CL1 | 120.1° | 120.0° |
H6 | C5 | C6 | H8 | 69.3° | 52.2° |
H6 | C5 | C6 | H9 | 50.9° | 172.6° |
H7 | C5 | C6 | H8 | 49.8° | 68.1° |
H7 | C5 | C6 | H9 | 170.0° | 52.3° |
H11 | C10 | C11 | H12 | 3.0° | 0.0° |
H13 | C13 | C14 | H14 | 1.5° | 0.1° |
H15 | C15 | C16 | H17 | 63.3° | 57.7° |
H15 | C15 | C16 | H18 | 56.1° | 177.8° |
H16 | C15 | C16 | H17 | 56.4° | 62.6° |
H16 | C15 | C16 | H18 | 175.8° | 57.5° |
H19 | C17 | C18 | H21 | 59.2° | 62.5° |
H19 | C17 | C18 | H22 | 60.8° | 57.7° |
H20 | C17 | C18 | H21 | 60.4° | 57.5° |
H20 | C17 | C18 | H22 | 179.6° | 177.7° |
H23 | C19 | C20 | H25 | 54.4° | 68.1° |
H23 | C19 | C20 | H26 | 65.2° | 52.2° |
H24 | C19 | C20 | H25 | 174.6° | 52.3° |
H24 | C19 | C20 | H26 | 55.0° | 172.6° |