J7R
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
O4 | C15 | doub | 1.22Å | 1.20Å | |
C21 | C22 | doub | 1.39Å | 1.40Å | Aromatic |
C21 | C20 | sing | 1.36Å | 1.39Å | Aromatic |
C22 | C23 | sing | 1.36Å | 1.39Å | Aromatic |
C20 | C19 | doub | 1.40Å | 1.43Å | Aromatic |
C23 | C24 | doub | 1.40Å | 1.43Å | Aromatic |
C19 | C24 | sing | 1.42Å | 1.37Å | Aromatic |
C19 | C18 | sing | 1.40Å | 1.43Å | Aromatic |
C24 | C16 | sing | 1.46Å | 1.42Å | Aromatic |
C18 | N5 | doub | 1.31Å | 1.33Å | Aromatic |
C16 | C15 | sing | 1.48Å | 1.52Å | |
C16 | C17 | doub | 1.39Å | 1.39Å | Aromatic |
N5 | C17 | sing | 1.32Å | 1.34Å | Aromatic |
C15 | N4 | sing | 1.35Å | 1.44Å | |
C13 | C14 | sing | 1.53Å | 1.52Å | |
C13 | C12 | sing | 1.53Å | 1.53Å | |
N4 | C14 | sing | 1.46Å | 1.45Å | |
C14 | C9 | sing | 1.53Å | 1.53Å | |
C12 | C11 | sing | 1.53Å | 1.53Å | |
C11 | C10 | sing | 1.53Å | 1.53Å | |
C9 | C10 | sing | 1.53Å | 1.53Å | |
C9 | N3 | sing | 1.47Å | 1.48Å | |
C1 | N1 | sing | 1.47Å | 1.45Å | |
O1 | C2 | doub | 1.22Å | 1.18Å | |
N3 | C8 | sing | 1.39Å | 1.46Å | |
C2 | N1 | sing | 1.35Å | 1.45Å | |
C2 | C3 | sing | 1.47Å | 1.52Å | |
O3 | N2 | sing | 1.22Å | 1.40Å | |
C8 | C3 | doub | 1.40Å | 1.40Å | Aromatic |
C8 | C7 | sing | 1.39Å | 1.39Å | Aromatic |
C3 | C4 | sing | 1.40Å | 1.37Å | Aromatic |
N2 | C7 | sing | 1.48Å | 1.43Å | |
N2 | O2 | doub | 1.22Å | 1.17Å | |
C7 | C6 | doub | 1.38Å | 1.37Å | Aromatic |
C4 | C5 | doub | 1.38Å | 1.37Å | Aromatic |
C6 | C5 | sing | 1.39Å | 1.37Å | Aromatic |
C5 | BR1 | sing | 1.89Å | 1.91Å | |
N1 | H1 | sing | 0.97Å | 1.00Å | |
N3 | H2 | sing | 1.01Å | 1.00Å | |
C4 | H3 | sing | 1.08Å | 1.08Å | |
C6 | H4 | sing | 1.08Å | 1.08Å | |
C10 | H5 | sing | 1.09Å | 1.10Å | |
C10 | H6 | sing | 1.09Å | 1.10Å | |
C13 | H7 | sing | 1.09Å | 1.10Å | |
C13 | H8 | sing | 1.09Å | 1.10Å | |
C17 | H9 | sing | 1.08Å | 1.08Å | |
C20 | H10 | sing | 1.08Å | 1.08Å | |
C21 | H11 | sing | 1.08Å | 1.08Å | |
C22 | H12 | sing | 1.08Å | 1.08Å | |
C1 | H13 | sing | 1.09Å | 1.10Å | |
C1 | H14 | sing | 1.09Å | 1.10Å | |
C1 | H15 | sing | 1.09Å | 1.10Å | |
C11 | H16 | sing | 1.09Å | 1.10Å | |
C11 | H17 | sing | 1.09Å | 1.10Å | |
C12 | H18 | sing | 1.09Å | 1.10Å | |
C12 | H19 | sing | 1.09Å | 1.10Å | |
C14 | H20 | sing | 1.09Å | 1.10Å | |
C18 | H21 | sing | 1.08Å | 1.08Å | |
C23 | H22 | sing | 1.08Å | 1.08Å | |
C9 | H23 | sing | 1.09Å | 1.10Å | |
N4 | H24 | sing | 0.97Å | 1.00Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O4 | C15 | C16 | 122.3° | 120.0° |
O4 | C15 | N4 | 123.4° | 120.0° |
C22 | C21 | C20 | 120.5° | 121.1° |
C21 | C22 | C23 | 120.4° | 120.9° |
C22 | C21 | H11 | 119.8° | 119.5° |
C21 | C22 | H12 | 119.8° | 119.5° |
C21 | C20 | C19 | 119.5° | 119.5° |
C21 | C20 | H10 | 120.3° | 120.3° |
C20 | C21 | H11 | 119.8° | 119.4° |
C22 | C23 | C24 | 119.0° | 119.5° |
C23 | C22 | H12 | 119.8° | 119.6° |
C22 | C23 | H22 | 120.5° | 120.3° |
C20 | C19 | C24 | 119.8° | 119.2° |
C20 | C19 | C18 | 120.9° | 122.2° |
C19 | C20 | H10 | 120.2° | 120.2° |
C23 | C24 | C19 | 120.8° | 119.8° |
C23 | C24 | C16 | 121.1° | 122.5° |
C24 | C23 | H22 | 120.5° | 120.2° |
C24 | C19 | C18 | 119.3° | 118.6° |
C19 | C24 | C16 | 118.0° | 117.8° |
C19 | C18 | N5 | 121.6° | 120.9° |
C19 | C18 | H21 | 119.2° | 119.5° |
C24 | C16 | C15 | 118.0° | 121.2° |
C24 | C16 | C17 | 119.3° | 117.7° |
C18 | N5 | C17 | 120.0° | 123.8° |
N5 | C18 | H21 | 119.2° | 119.6° |
C15 | C16 | C17 | 122.6° | 121.2° |
C16 | C15 | N4 | 114.3° | 120.0° |
C16 | C17 | N5 | 121.9° | 121.3° |
C16 | C17 | H9 | 119.1° | 119.3° |
N5 | C17 | H9 | 119.1° | 119.4° |
C15 | N4 | C14 | 122.6° | 120.0° |
C15 | N4 | H24 | 118.7° | 120.0° |
C14 | C13 | C12 | 112.6° | 109.5° |
C13 | C14 | N4 | 111.7° | 109.5° |
C13 | C14 | C9 | 114.2° | 109.5° |
C14 | C13 | H7 | 108.7° | 109.5° |
C14 | C13 | H8 | 108.7° | 109.5° |
C13 | C14 | H20 | 108.3° | 109.4° |
C13 | C12 | C11 | 116.3° | 109.4° |
C12 | C13 | H7 | 108.7° | 109.4° |
C12 | C13 | H8 | 108.7° | 109.4° |
C13 | C12 | H18 | 107.7° | 109.5° |
C13 | C12 | H19 | 107.7° | 109.4° |
N4 | C14 | C9 | 105.1° | 109.5° |
N4 | C14 | H20 | 109.2° | 109.4° |
C14 | N4 | H24 | 118.8° | 120.0° |
C14 | C9 | C10 | 113.0° | 109.4° |
C14 | C9 | N3 | 111.7° | 109.5° |
C9 | C14 | H20 | 108.2° | 109.5° |
C14 | C9 | H23 | 107.7° | 109.5° |
C12 | C11 | C10 | 114.9° | 109.5° |
C12 | C11 | H16 | 108.1° | 109.4° |
C12 | C11 | H17 | 108.1° | 109.5° |
C11 | C12 | H18 | 107.7° | 109.5° |
C11 | C12 | H19 | 107.7° | 109.5° |
C11 | C10 | C9 | 114.7° | 109.5° |
C11 | C10 | H5 | 108.1° | 109.4° |
C11 | C10 | H6 | 108.2° | 109.5° |
C10 | C11 | H16 | 108.1° | 109.5° |
C10 | C11 | H17 | 108.1° | 109.5° |
C10 | C9 | N3 | 108.3° | 109.5° |
C9 | C10 | H5 | 108.2° | 109.4° |
C9 | C10 | H6 | 108.1° | 109.5° |
C10 | C9 | H23 | 107.7° | 109.5° |
C9 | N3 | C8 | 113.9° | 111.0° |
C9 | N3 | H2 | 108.4° | 111.0° |
N3 | C9 | H23 | 108.3° | 109.5° |
C1 | N1 | C2 | 119.0° | 120.0° |
C1 | N1 | H1 | 120.5° | 120.0° |
N1 | C1 | H13 | 109.5° | 109.5° |
N1 | C1 | H14 | 109.5° | 109.5° |
N1 | C1 | H15 | 109.5° | 109.5° |
O1 | C2 | N1 | 120.7° | 119.9° |
O1 | C2 | C3 | 117.3° | 120.0° |
N3 | C8 | C3 | 120.6° | 120.1° |
N3 | C8 | C7 | 120.4° | 120.2° |
C8 | N3 | H2 | 108.3° | 111.0° |
N1 | C2 | C3 | 121.9° | 120.0° |
C2 | N1 | H1 | 120.5° | 120.0° |
C2 | C3 | C8 | 123.4° | 120.2° |
C2 | C3 | C4 | 116.5° | 120.2° |
O3 | N2 | C7 | 119.7° | 120.0° |
O3 | N2 | O2 | 122.0° | 120.0° |
C3 | C8 | C7 | 119.1° | 119.7° |
C8 | C3 | C4 | 120.1° | 119.6° |
C8 | C7 | N2 | 122.2° | 119.9° |
C8 | C7 | C6 | 121.0° | 120.1° |
C3 | C4 | C5 | 118.9° | 119.9° |
C3 | C4 | H3 | 120.6° | 120.0° |
C7 | N2 | O2 | 118.2° | 120.0° |
N2 | C7 | C6 | 116.8° | 120.0° |
C7 | C6 | C5 | 118.4° | 120.4° |
C7 | C6 | H4 | 120.8° | 119.8° |
C4 | C5 | C6 | 122.5° | 120.3° |
C4 | C5 | BR1 | 118.3° | 119.8° |
C5 | C4 | H3 | 120.5° | 120.1° |
C6 | C5 | BR1 | 119.2° | 119.8° |
C5 | C6 | H4 | 120.8° | 119.8° |
H5 | C10 | H6 | 109.5° | 109.5° |
H7 | C13 | H8 | 109.5° | 109.5° |
H13 | C1 | H14 | 109.4° | 109.5° |
H13 | C1 | H15 | 109.5° | 109.4° |
H14 | C1 | H15 | 109.5° | 109.5° |
H16 | C11 | H17 | 109.5° | 109.5° |
H18 | C12 | H19 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O4 | C15 | C16 | C24 | 78.6° | 0.0° |
O4 | C15 | C16 | N4 | 180.0° | 179.9° |
O4 | C15 | C16 | C17 | 104.1° | 180.0° |
O4 | C15 | N4 | C14 | 2.7° | 0.1° |
O4 | C15 | N4 | H24 | 177.3° | 180.0° |
C22 | C21 | C20 | H11 | 180.0° | 179.9° |
C21 | C22 | C23 | H12 | 180.0° | 180.0° |
C22 | C21 | C20 | C19 | 0.7° | 0.1° |
C21 | C22 | C23 | C24 | 1.2° | 0.0° |
C22 | C21 | C20 | H10 | 179.3° | 180.0° |
C21 | C22 | C23 | H22 | 178.8° | 180.0° |
C20 | C21 | C22 | C23 | 1.3° | 0.0° |
C21 | C20 | C19 | H10 | 180.0° | 179.9° |
C21 | C20 | C19 | C24 | 0.1° | 0.1° |
C21 | C20 | C19 | C18 | 179.8° | 179.8° |
C20 | C21 | C22 | H12 | 178.7° | 179.9° |
C22 | C23 | C24 | H22 | 180.0° | 180.0° |
C22 | C23 | C24 | C19 | 0.6° | 0.0° |
C22 | C23 | C24 | C16 | 178.7° | 180.0° |
C23 | C22 | C21 | H11 | 178.7° | 179.9° |
C20 | C19 | C24 | C23 | 0.0° | 0.1° |
C20 | C19 | C24 | C18 | 179.8° | 179.7° |
C20 | C19 | C24 | C16 | 179.3° | 180.0° |
C20 | C19 | C18 | N5 | 179.7° | 180.0° |
C19 | C20 | C21 | H11 | 179.3° | 180.0° |
C20 | C19 | C18 | H21 | 0.3° | 0.0° |
C23 | C24 | C19 | C16 | 179.3° | 180.0° |
C23 | C24 | C19 | C18 | 179.9° | 179.7° |
C23 | C24 | C16 | C15 | 1.5° | 0.0° |
C23 | C24 | C16 | C17 | 178.9° | 180.0° |
C24 | C23 | C22 | H12 | 178.8° | 180.0° |
C24 | C19 | C18 | N5 | 0.1° | 0.3° |
C19 | C24 | C16 | C15 | 179.2° | 180.0° |
C19 | C24 | C16 | C17 | 1.8° | 0.0° |
C24 | C19 | C20 | H10 | 179.9° | 180.0° |
C24 | C19 | C18 | H21 | 179.9° | 179.7° |
C19 | C24 | C23 | H22 | 179.4° | 180.0° |
C18 | C19 | C24 | C16 | 0.9° | 0.3° |
C19 | C18 | N5 | H21 | 180.0° | 179.9° |
C19 | C18 | N5 | C17 | 0.2° | 0.1° |
C18 | C19 | C20 | H10 | 0.2° | 0.3° |
C24 | C16 | C15 | C17 | 177.3° | 180.0° |
C24 | C16 | C17 | N5 | 1.9° | 0.3° |
C24 | C16 | C15 | N4 | 101.4° | 180.0° |
C24 | C16 | C17 | H9 | 178.1° | 179.9° |
C16 | C24 | C23 | H22 | 1.3° | 0.0° |
C18 | N5 | C17 | C16 | 0.9° | 0.2° |
C18 | N5 | C17 | H9 | 179.1° | 179.9° |
C15 | C16 | C17 | N5 | 179.1° | 179.8° |
C16 | C15 | N4 | C14 | 177.3° | 180.0° |
C15 | C16 | C17 | H9 | 0.9° | 0.1° |
C16 | C15 | N4 | H24 | 2.7° | 0.1° |
C16 | C17 | N5 | H9 | 180.0° | 179.7° |
C17 | C16 | C15 | N4 | 75.9° | 0.1° |
C17 | N5 | C18 | H21 | 179.8° | 180.0° |
C15 | N4 | C14 | C13 | 73.3° | 84.9° |
C15 | N4 | C14 | H24 | 180.0° | 179.9° |
C15 | N4 | C14 | C9 | 162.3° | 155.0° |
C15 | N4 | C14 | H20 | 46.5° | 35.0° |
C14 | C13 | C12 | H7 | 120.5° | 120.1° |
C14 | C13 | C12 | H8 | 120.5° | 120.0° |
C13 | C14 | N4 | C9 | 124.4° | 120.1° |
C13 | C14 | N4 | H20 | 119.8° | 120.0° |
C13 | C14 | C9 | H20 | 120.7° | 120.0° |
C14 | C13 | C12 | C11 | 8.4° | 60.0° |
C13 | C14 | C9 | C10 | 55.4° | 60.0° |
C13 | C14 | C9 | N3 | 66.9° | 180.0° |
C14 | C13 | H7 | H8 | 118.6° | 120.0° |
C14 | C13 | C12 | H18 | 129.4° | 180.0° |
C14 | C13 | C12 | H19 | 112.6° | 60.0° |
C13 | C14 | C9 | H23 | 174.2° | 60.0° |
C13 | C14 | N4 | H24 | 106.6° | 95.0° |
C12 | C13 | C14 | N4 | 160.9° | 60.0° |
C12 | C13 | C14 | C9 | 41.9° | 60.0° |
C13 | C12 | C11 | H18 | 121.0° | 120.0° |
C13 | C12 | C11 | H19 | 121.0° | 119.9° |
C13 | C12 | C11 | C10 | 46.7° | 60.0° |
C12 | C13 | H7 | H8 | 118.6° | 119.9° |
C13 | C12 | C11 | H16 | 74.1° | 179.9° |
C13 | C12 | C11 | H17 | 167.5° | 60.1° |
C13 | C12 | H18 | H19 | 116.9° | 120.0° |
C12 | C13 | C14 | H20 | 78.7° | 180.0° |
N4 | C14 | C9 | H20 | 116.6° | 119.9° |
N4 | C14 | C9 | C10 | 178.2° | 60.0° |
N4 | C14 | C9 | N3 | 55.8° | 59.9° |
N4 | C14 | C13 | H7 | 78.6° | 60.0° |
N4 | C14 | C13 | H8 | 40.5° | 180.0° |
N4 | C14 | C9 | H23 | 63.0° | 180.0° |
C14 | C9 | C10 | C11 | 16.2° | 60.0° |
C14 | C9 | C10 | N3 | 124.3° | 120.0° |
C14 | C9 | C10 | H23 | 118.8° | 120.0° |
C14 | C9 | N3 | H23 | 118.4° | 120.0° |
C14 | C9 | N3 | C8 | 157.8° | 154.7° |
C14 | C9 | N3 | H2 | 81.5° | 81.3° |
C14 | C9 | C10 | H5 | 104.5° | 180.0° |
C14 | C9 | C10 | H6 | 137.0° | 60.0° |
C9 | C14 | C13 | H7 | 162.4° | 180.0° |
C9 | C14 | C13 | H8 | 78.6° | 60.0° |
C9 | C14 | N4 | H24 | 17.7° | 25.1° |
C12 | C11 | C10 | H16 | 120.8° | 119.9° |
C12 | C11 | C10 | H17 | 120.8° | 120.0° |
C12 | C11 | C10 | C9 | 32.7° | 60.1° |
C12 | C11 | C10 | H5 | 153.5° | 180.0° |
C12 | C11 | C10 | H6 | 88.0° | 60.0° |
C11 | C12 | C13 | H7 | 112.1° | 180.0° |
C11 | C12 | C13 | H8 | 128.9° | 60.0° |
C12 | C11 | H16 | H17 | 117.5° | 120.0° |
C11 | C12 | H18 | H19 | 116.9° | 120.0° |
C11 | C10 | C9 | H5 | 120.8° | 119.9° |
C11 | C10 | C9 | H6 | 120.8° | 120.0° |
C11 | C10 | C9 | N3 | 108.0° | 180.0° |
C11 | C10 | H5 | H6 | 117.6° | 120.0° |
C10 | C11 | H16 | H17 | 117.5° | 120.1° |
C10 | C11 | C12 | H18 | 167.7° | 180.0° |
C10 | C11 | C12 | H19 | 74.3° | 59.9° |
C11 | C10 | C9 | H23 | 135.0° | 59.9° |
C10 | C9 | N3 | H23 | 116.5° | 120.0° |
C10 | C9 | N3 | C8 | 77.2° | 85.3° |
C10 | C9 | N3 | H2 | 43.5° | 38.6° |
C9 | C10 | H5 | H6 | 117.6° | 120.1° |
C9 | C10 | C11 | H16 | 88.1° | 180.0° |
C9 | C10 | C11 | H17 | 153.5° | 60.0° |
C10 | C9 | C14 | H20 | 65.2° | 180.0° |
C9 | N3 | C8 | H2 | 120.7° | 124.0° |
C9 | N3 | C8 | C3 | 68.8° | 95.0° |
C9 | N3 | C8 | C7 | 109.5° | 85.5° |
N3 | C9 | C10 | H5 | 131.2° | 60.0° |
N3 | C9 | C10 | H6 | 12.7° | 60.0° |
N3 | C9 | C14 | H20 | 172.4° | 60.0° |
C1 | N1 | C2 | O1 | 0.7° | 0.3° |
C1 | N1 | C2 | H1 | 180.0° | 179.7° |
C1 | N1 | C2 | C3 | 178.8° | 179.7° |
N1 | C1 | H13 | H14 | 120.0° | 120.1° |
N1 | C1 | H13 | H15 | 120.0° | 120.0° |
N1 | C1 | H14 | H15 | 120.0° | 120.1° |
O1 | C2 | N1 | C3 | 178.0° | 180.0° |
O1 | C2 | C3 | C8 | 41.4° | 6.4° |
O1 | C2 | C3 | C4 | 136.2° | 173.5° |
O1 | C2 | N1 | H1 | 179.2° | 180.0° |
N3 | C8 | C3 | C2 | 3.2° | 0.1° |
N3 | C8 | C3 | C7 | 178.3° | 179.5° |
N3 | C8 | C3 | C4 | 179.3° | 180.0° |
N3 | C8 | C7 | N2 | 2.0° | 0.3° |
N3 | C8 | C7 | C6 | 178.6° | 179.7° |
C8 | N3 | C9 | H23 | 39.4° | 34.7° |
N1 | C2 | C3 | C8 | 140.5° | 173.6° |
N1 | C2 | C3 | C4 | 41.9° | 6.4° |
C2 | N1 | C1 | H13 | 180.0° | 179.7° |
C2 | N1 | C1 | H14 | 60.0° | 59.7° |
C2 | N1 | C1 | H15 | 60.0° | 60.3° |
C2 | C3 | C8 | C4 | 177.5° | 179.9° |
C2 | C3 | C8 | C7 | 178.5° | 179.5° |
C2 | C3 | C4 | C5 | 179.2° | 179.4° |
C3 | C2 | N1 | H1 | 1.2° | 0.0° |
C2 | C3 | C4 | H3 | 0.8° | 0.3° |
O3 | N2 | C7 | C8 | 11.2° | 5.7° |
O3 | N2 | C7 | O2 | 176.5° | 180.0° |
O3 | N2 | C7 | C6 | 168.2° | 174.3° |
C3 | C8 | C7 | N2 | 179.7° | 179.8° |
C3 | C8 | C7 | C6 | 0.3° | 0.2° |
C8 | C3 | C4 | C5 | 1.5° | 0.5° |
C3 | C8 | N3 | H2 | 170.6° | 29.0° |
C8 | C3 | C4 | H3 | 178.5° | 179.7° |
C7 | C8 | C3 | C4 | 1.0° | 0.5° |
C8 | C7 | N2 | C6 | 179.4° | 180.0° |
C8 | C7 | N2 | O2 | 172.3° | 174.3° |
C8 | C7 | C6 | C5 | 0.2° | 0.0° |
C7 | C8 | N3 | H2 | 11.2° | 150.5° |
C8 | C7 | C6 | H4 | 179.8° | 180.0° |
C3 | C4 | C5 | H3 | 180.0° | 179.8° |
C3 | C4 | C5 | C6 | 1.4° | 0.2° |
C3 | C4 | C5 | BR1 | 179.3° | 179.8° |
N2 | C7 | C6 | C5 | 179.6° | 180.0° |
N2 | C7 | C6 | H4 | 0.4° | 0.0° |
O2 | N2 | C7 | C6 | 8.3° | 5.7° |
C7 | C6 | C5 | C4 | 0.7° | 0.0° |
C7 | C6 | C5 | H4 | 180.0° | 180.0° |
C7 | C6 | C5 | BR1 | 180.0° | 180.0° |
C4 | C5 | C6 | BR1 | 179.3° | 180.0° |
C4 | C5 | C6 | H4 | 179.3° | 180.0° |
C6 | C5 | C4 | H3 | 178.6° | 180.0° |
BR1 | C5 | C4 | H3 | 0.7° | 0.0° |
BR1 | C5 | C6 | H4 | 0.0° | 0.0° |
H1 | N1 | C1 | H13 | 0.0° | 0.1° |
H1 | N1 | C1 | H14 | 120.0° | 120.0° |
H1 | N1 | C1 | H15 | 120.0° | 120.0° |
H2 | N3 | C9 | H23 | 160.0° | 158.7° |
H5 | C10 | C11 | H16 | 32.7° | 60.1° |
H5 | C10 | C11 | H17 | 85.7° | 60.0° |
H5 | C10 | C9 | H23 | 14.2° | 60.0° |
H6 | C10 | C11 | H16 | 151.2° | 59.9° |
H6 | C10 | C11 | H17 | 32.8° | 180.0° |
H6 | C10 | C9 | H23 | 104.2° | 180.0° |
H7 | C13 | C12 | H18 | 8.9° | 60.0° |
H7 | C13 | C12 | H19 | 126.9° | 60.1° |
H7 | C13 | C14 | H20 | 41.8° | 60.0° |
H8 | C13 | C12 | H18 | 110.1° | 60.0° |
H8 | C13 | C12 | H19 | 7.9° | 180.0° |
H8 | C13 | C14 | H20 | 160.8° | 60.0° |
H10 | C20 | C21 | H11 | 0.7° | 0.1° |
H11 | C21 | C22 | H12 | 1.3° | 0.0° |
H12 | C22 | C23 | H22 | 1.2° | 0.0° |
H13 | C1 | H14 | H15 | 120.0° | 119.9° |
H16 | C11 | C12 | H18 | 46.9° | 60.0° |
H16 | C11 | C12 | H19 | 164.9° | 60.0° |
H17 | C11 | C12 | H18 | 71.5° | 59.9° |
H17 | C11 | C12 | H19 | 46.5° | 180.0° |
H20 | C14 | C9 | H23 | 53.6° | 60.0° |
H20 | C14 | N4 | H24 | 133.6° | 145.0° |