J78
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C1 | C2 | sing | 1.51Å | 1.51Å | |
C1 | H11 | sing | 1.09Å | 1.12Å | |
C1 | H12 | sing | 1.09Å | 1.11Å | |
C1 | H13 | sing | 1.09Å | 1.12Å | |
C2 | C3 | sing | 1.39Å | 1.37Å | Aromatic |
C2 | N3 | doub | 1.32Å | 1.33Å | Aromatic |
C3 | C4 | doub | 1.39Å | 1.39Å | Aromatic |
C3 | H3 | sing | 1.08Å | 1.10Å | |
C4 | C5 | sing | 1.39Å | 1.39Å | Aromatic |
C4 | H4 | sing | 1.08Å | 1.10Å | |
C5 | N4 | doub | 1.32Å | 1.34Å | Aromatic |
C5 | N6 | sing | 1.39Å | 1.35Å | |
N4 | N3 | sing | 1.28Å | 1.34Å | Aromatic |
N6 | C7 | sing | 1.47Å | 1.47Å | |
N6 | C11 | sing | 1.47Å | 1.47Å | |
C7 | C8 | sing | 1.53Å | 1.51Å | |
C7 | H71 | sing | 1.09Å | 1.11Å | |
C7 | H72 | sing | 1.09Å | 1.12Å | |
C8 | C9 | sing | 1.53Å | 1.51Å | |
C8 | H81 | sing | 1.09Å | 1.11Å | |
C8 | H82 | sing | 1.09Å | 1.12Å | |
C9 | C10 | sing | 1.53Å | 1.51Å | |
C9 | C12 | sing | 1.53Å | 1.50Å | |
C9 | H9 | sing | 1.09Å | 1.11Å | |
C10 | C11 | sing | 1.53Å | 1.53Å | |
C10 | H101 | sing | 1.09Å | 1.11Å | |
C10 | H102 | sing | 1.09Å | 1.12Å | |
C11 | H111 | sing | 1.09Å | 1.12Å | |
C11 | H112 | sing | 1.09Å | 1.11Å | |
C12 | C13 | sing | 1.53Å | 1.49Å | |
C12 | H121 | sing | 1.09Å | 1.12Å | |
C12 | H122 | sing | 1.09Å | 1.11Å | |
C13 | C14 | sing | 1.53Å | 1.50Å | |
C13 | H131 | sing | 1.09Å | 1.11Å | |
C13 | H132 | sing | 1.09Å | 1.12Å | |
C14 | O15 | sing | 1.43Å | 1.41Å | |
C14 | H141 | sing | 1.09Å | 1.12Å | |
C14 | H142 | sing | 1.09Å | 1.11Å | |
O15 | C16 | sing | 1.36Å | 1.36Å | |
C16 | C17 | doub | 1.39Å | 1.38Å | Aromatic |
C16 | C21 | sing | 1.39Å | 1.39Å | Aromatic |
C17 | C18 | sing | 1.38Å | 1.39Å | Aromatic |
C17 | H17 | sing | 1.08Å | 1.10Å | |
C18 | C19 | doub | 1.40Å | 1.39Å | Aromatic |
C18 | H18 | sing | 1.08Å | 1.10Å | |
C19 | C20 | sing | 1.40Å | 1.39Å | Aromatic |
C19 | C22 | sing | 1.48Å | 1.38Å | |
C20 | C21 | doub | 1.38Å | 1.38Å | Aromatic |
C20 | H20 | sing | 1.08Å | 1.10Å | |
C21 | H21 | sing | 1.08Å | 1.10Å | |
C22 | O23 | doub | 1.22Å | 1.24Å | |
C22 | O24 | sing | 1.35Å | 1.46Å | |
O24 | C25 | sing | 1.45Å | 1.39Å | |
C25 | C26 | sing | 1.53Å | 1.55Å | |
C25 | H251 | sing | 1.09Å | 1.11Å | |
C25 | H252 | sing | 1.09Å | 1.11Å | |
C26 | H261 | sing | 1.09Å | 1.11Å | |
C26 | H262 | sing | 1.09Å | 1.12Å | |
C26 | H263 | sing | 1.09Å | 1.11Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C2 | C1 | H11 | 120.3° | 109.5° |
C2 | C1 | H12 | 108.3° | 109.5° |
C2 | C1 | H13 | 108.3° | 109.5° |
C1 | C2 | C3 | 120.3° | 119.9° |
C1 | C2 | N3 | 117.7° | 120.1° |
H11 | C1 | H12 | 108.3° | 109.5° |
H11 | C1 | H13 | 108.3° | 109.4° |
H12 | C1 | H13 | 101.6° | 109.4° |
C3 | C2 | N3 | 122.0° | 120.0° |
C2 | C3 | C4 | 118.1° | 118.0° |
C2 | C3 | H3 | 120.4° | 121.0° |
C2 | N3 | N4 | 119.1° | 122.3° |
C4 | C3 | H3 | 121.4° | 121.0° |
C3 | C4 | C5 | 119.6° | 117.9° |
C3 | C4 | H4 | 120.2° | 121.1° |
C5 | C4 | H4 | 120.2° | 121.0° |
C4 | C5 | N4 | 118.1° | 119.7° |
C4 | C5 | N6 | 121.0° | 120.2° |
N4 | C5 | N6 | 120.9° | 120.1° |
C5 | N4 | N3 | 123.1° | 122.1° |
C5 | N6 | C7 | 117.7° | 106.8° |
C5 | N6 | C11 | 120.2° | 106.7° |
C7 | N6 | C11 | 122.1° | 107.3° |
N6 | C7 | C8 | 113.0° | 109.8° |
N6 | C7 | H71 | 110.9° | 109.4° |
N6 | C7 | H72 | 110.9° | 109.4° |
N6 | C11 | C10 | 115.3° | 109.8° |
N6 | C11 | H111 | 110.1° | 109.4° |
N6 | C11 | H112 | 110.1° | 109.4° |
C8 | C7 | H71 | 110.9° | 109.4° |
C8 | C7 | H72 | 110.9° | 109.4° |
C7 | C8 | C9 | 111.5° | 109.2° |
C7 | C8 | H81 | 111.5° | 109.6° |
C7 | C8 | H82 | 111.5° | 109.5° |
H71 | C7 | H72 | 99.4° | 109.3° |
C9 | C8 | H81 | 111.5° | 109.5° |
C9 | C8 | H82 | 111.4° | 109.5° |
C8 | C9 | C10 | 115.2° | 108.9° |
C8 | C9 | C12 | 111.5° | 109.6° |
C8 | C9 | H9 | 104.3° | 109.5° |
H81 | C8 | H82 | 98.9° | 109.5° |
C10 | C9 | C12 | 110.6° | 109.6° |
C10 | C9 | H9 | 105.3° | 109.7° |
C9 | C10 | C11 | 118.0° | 109.2° |
C9 | C10 | H101 | 109.1° | 109.5° |
C9 | C10 | H102 | 109.2° | 109.5° |
C12 | C9 | H9 | 109.5° | 109.6° |
C9 | C12 | C13 | 108.8° | 109.5° |
C9 | C12 | H121 | 112.5° | 109.5° |
C9 | C12 | H122 | 112.5° | 109.5° |
C11 | C10 | H101 | 109.1° | 109.5° |
C11 | C10 | H102 | 109.1° | 109.6° |
C10 | C11 | H111 | 110.1° | 109.4° |
C10 | C11 | H112 | 110.1° | 109.4° |
H101 | C10 | H102 | 101.0° | 109.5° |
H111 | C11 | H112 | 100.1° | 109.4° |
C13 | C12 | H121 | 112.5° | 109.5° |
C13 | C12 | H122 | 112.5° | 109.5° |
C12 | C13 | C14 | 109.5° | 109.4° |
C12 | C13 | H131 | 112.2° | 109.5° |
C12 | C13 | H132 | 112.2° | 109.5° |
H121 | C12 | H122 | 97.9° | 109.4° |
C14 | C13 | H131 | 112.2° | 109.4° |
C14 | C13 | H132 | 112.2° | 109.4° |
C13 | C14 | O15 | 109.5° | 109.5° |
C13 | C14 | H141 | 112.2° | 109.5° |
C13 | C14 | H142 | 112.2° | 109.5° |
H131 | C13 | H132 | 98.3° | 109.5° |
O15 | C14 | H141 | 112.1° | 109.4° |
O15 | C14 | H142 | 112.1° | 109.4° |
C14 | O15 | C16 | 111.9° | 106.8° |
H141 | C14 | H142 | 98.3° | 109.5° |
O15 | C16 | C17 | 120.1° | 119.9° |
O15 | C16 | C21 | 117.3° | 119.9° |
C17 | C16 | C21 | 120.5° | 120.1° |
C16 | C17 | C18 | 119.7° | 120.1° |
C16 | C17 | H17 | 119.9° | 119.9° |
C16 | C21 | C20 | 119.4° | 120.1° |
C16 | C21 | H21 | 120.6° | 119.9° |
C18 | C17 | H17 | 120.4° | 119.9° |
C17 | C18 | C19 | 120.3° | 119.9° |
C17 | C18 | H18 | 119.8° | 120.1° |
C19 | C18 | H18 | 119.9° | 120.0° |
C18 | C19 | C20 | 119.7° | 119.8° |
C18 | C19 | C22 | 120.6° | 120.1° |
C20 | C19 | C22 | 119.6° | 120.1° |
C19 | C20 | C21 | 120.3° | 120.0° |
C19 | C20 | H20 | 120.1° | 120.0° |
C19 | C22 | O23 | 121.1° | 120.0° |
C19 | C22 | O24 | 118.0° | 120.0° |
C21 | C20 | H20 | 119.7° | 120.1° |
C20 | C21 | H21 | 120.0° | 120.0° |
O23 | C22 | O24 | 120.9° | 120.0° |
C22 | O24 | C25 | 118.6° | 120.0° |
O24 | C25 | C26 | 126.9° | 109.5° |
O24 | C25 | H251 | 106.1° | 109.5° |
O24 | C25 | H252 | 106.1° | 109.5° |
C26 | C25 | H251 | 106.1° | 109.5° |
C26 | C25 | H252 | 106.1° | 109.5° |
C25 | C26 | H261 | 126.9° | 109.5° |
C25 | C26 | H262 | 106.1° | 109.5° |
C25 | C26 | H263 | 106.1° | 109.5° |
H251 | C25 | H252 | 103.4° | 109.4° |
H261 | C26 | H262 | 106.2° | 109.4° |
H261 | C26 | H263 | 106.1° | 109.5° |
H262 | C26 | H263 | 103.3° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C2 | C1 | H11 | H12 | 125.3° | 120.1° |
C2 | C1 | H11 | H13 | 125.2° | 120.0° |
C2 | C1 | H12 | H13 | 114.0° | 120.0° |
C1 | C2 | C3 | N3 | 179.0° | 179.9° |
C1 | C2 | C3 | C4 | 178.7° | 180.0° |
C1 | C2 | C3 | H3 | 1.4° | 0.0° |
C1 | C2 | N3 | N4 | 178.5° | 179.8° |
H11 | C1 | H12 | H13 | 113.9° | 119.9° |
H11 | C1 | C2 | C3 | 180.0° | 30.0° |
H11 | C1 | C2 | N3 | 1.0° | 150.0° |
H12 | C1 | C2 | C3 | 54.7° | 90.0° |
H12 | C1 | C2 | N3 | 124.3° | 89.9° |
H13 | C1 | C2 | C3 | 54.7° | 150.0° |
H13 | C1 | C2 | N3 | 126.2° | 30.1° |
C2 | C3 | C4 | H3 | 179.9° | 180.0° |
C2 | C3 | C4 | C5 | 0.4° | 0.0° |
C2 | C3 | C4 | H4 | 179.5° | 179.9° |
C3 | C2 | N3 | N4 | 0.5° | 0.2° |
N3 | C2 | C3 | C4 | 0.3° | 0.0° |
N3 | C2 | C3 | H3 | 179.6° | 179.9° |
C2 | N3 | N4 | C5 | 0.1° | 0.4° |
C3 | C4 | C5 | H4 | 179.9° | 180.0° |
C3 | C4 | C5 | N4 | 1.0° | 0.2° |
C3 | C4 | C5 | N6 | 175.9° | 180.0° |
H3 | C3 | C4 | C5 | 179.6° | 180.0° |
H3 | C3 | C4 | H4 | 0.4° | 0.1° |
C4 | C5 | N4 | N6 | 177.0° | 179.8° |
C4 | C5 | N4 | N3 | 0.9° | 0.4° |
C4 | C5 | N6 | C7 | 171.1° | 179.9° |
C4 | C5 | N6 | C11 | 8.0° | 65.5° |
H4 | C4 | C5 | N4 | 178.9° | 179.8° |
H4 | C4 | C5 | N6 | 4.1° | 0.0° |
N4 | C5 | N6 | C7 | 5.8° | 0.2° |
N4 | C5 | N6 | C11 | 175.1° | 114.3° |
N6 | C5 | N4 | N3 | 176.1° | 179.7° |
C5 | N6 | C7 | C11 | 179.1° | 114.1° |
C5 | N6 | C7 | C8 | 161.6° | 179.7° |
C5 | N6 | C7 | H71 | 73.1° | 59.6° |
C5 | N6 | C7 | H72 | 36.3° | 60.1° |
C5 | N6 | C11 | C10 | 161.7° | 179.7° |
C5 | N6 | C11 | H111 | 73.0° | 59.6° |
C5 | N6 | C11 | H112 | 36.4° | 60.2° |
N6 | C7 | C8 | H71 | 125.3° | 120.1° |
N6 | C7 | C8 | H72 | 125.2° | 120.2° |
N6 | C7 | H71 | H72 | 116.8° | 119.8° |
N6 | C7 | C8 | C9 | 52.5° | 61.3° |
N6 | C7 | C8 | H81 | 177.8° | 178.7° |
N6 | C7 | C8 | H82 | 72.7° | 58.6° |
C7 | N6 | C11 | C10 | 17.3° | 65.6° |
C7 | N6 | C11 | H111 | 107.9° | 54.5° |
C7 | N6 | C11 | H112 | 142.7° | 174.3° |
C11 | N6 | C7 | C8 | 19.3° | 65.6° |
C11 | N6 | C7 | H71 | 105.9° | 54.5° |
C11 | N6 | C7 | H72 | 144.6° | 174.2° |
N6 | C11 | C10 | C9 | 20.7° | 61.4° |
N6 | C11 | C10 | H111 | 125.3° | 120.1° |
N6 | C11 | C10 | H112 | 125.3° | 120.1° |
N6 | C11 | C10 | H101 | 104.6° | 58.5° |
N6 | C11 | C10 | H102 | 145.9° | 178.7° |
N6 | C11 | H111 | H112 | 115.9° | 119.8° |
C8 | C7 | H71 | H72 | 116.8° | 119.8° |
C7 | C8 | C9 | H81 | 125.3° | 120.0° |
C7 | C8 | C9 | H82 | 125.3° | 119.9° |
C7 | C8 | H81 | H82 | 117.4° | 120.1° |
C7 | C8 | C9 | C10 | 49.2° | 55.5° |
C7 | C8 | C9 | C12 | 176.3° | 175.4° |
C7 | C8 | C9 | H9 | 65.7° | 64.4° |
H71 | C7 | C8 | C9 | 72.8° | 58.8° |
H71 | C7 | C8 | H81 | 52.5° | 61.2° |
H71 | C7 | C8 | H82 | 162.0° | 178.7° |
H72 | C7 | C8 | C9 | 177.7° | 178.5° |
H72 | C7 | C8 | H81 | 57.0° | 58.5° |
H72 | C7 | C8 | H82 | 52.5° | 61.6° |
C9 | C8 | H81 | H82 | 117.3° | 120.1° |
C8 | C9 | C10 | C12 | 127.5° | 119.9° |
C8 | C9 | C10 | H9 | 114.3° | 119.8° |
C8 | C9 | C12 | H9 | 114.9° | 120.2° |
C8 | C9 | C10 | C11 | 12.4° | 55.6° |
C8 | C9 | C10 | H101 | 137.7° | 64.4° |
C8 | C9 | C10 | H102 | 112.8° | 175.5° |
C8 | C9 | C12 | C13 | 70.8° | 180.0° |
C8 | C9 | C12 | H121 | 54.4° | 60.0° |
C8 | C9 | C12 | H122 | 163.9° | 60.0° |
H81 | C8 | C9 | C10 | 174.5° | 175.5° |
H81 | C8 | C9 | C12 | 58.5° | 64.6° |
H81 | C8 | C9 | H9 | 59.6° | 55.6° |
H82 | C8 | C9 | C10 | 76.0° | 64.4° |
H82 | C8 | C9 | C12 | 51.0° | 55.5° |
H82 | C8 | C9 | H9 | 169.1° | 175.7° |
C10 | C9 | C12 | H9 | 115.6° | 120.4° |
C9 | C10 | C11 | H101 | 125.3° | 119.9° |
C9 | C10 | C11 | H102 | 125.2° | 120.0° |
C9 | C10 | H101 | H102 | 114.9° | 120.1° |
C9 | C10 | C11 | H111 | 104.6° | 58.7° |
C9 | C10 | C11 | H112 | 146.0° | 178.5° |
C10 | C9 | C12 | C13 | 159.7° | 60.6° |
C10 | C9 | C12 | H121 | 75.0° | 179.5° |
C10 | C9 | C12 | H122 | 34.4° | 59.5° |
C12 | C9 | C10 | C11 | 139.9° | 175.4° |
C12 | C9 | C10 | H101 | 94.8° | 55.5° |
C12 | C9 | C10 | H102 | 14.7° | 64.6° |
C9 | C12 | C13 | H121 | 125.3° | 120.0° |
C9 | C12 | C13 | H122 | 125.3° | 120.0° |
C9 | C12 | H121 | H122 | 118.4° | 120.0° |
C9 | C12 | C13 | C14 | 175.9° | 180.0° |
C9 | C12 | C13 | H131 | 58.8° | 60.0° |
C9 | C12 | C13 | H132 | 50.7° | 60.1° |
H9 | C9 | C10 | C11 | 101.9° | 64.2° |
H9 | C9 | C10 | H101 | 23.4° | 175.8° |
H9 | C9 | C10 | H102 | 132.9° | 55.7° |
H9 | C9 | C12 | C13 | 44.1° | 59.8° |
H9 | C9 | C12 | H121 | 169.4° | 60.2° |
H9 | C9 | C12 | H122 | 81.2° | 179.9° |
C11 | C10 | H101 | H102 | 114.8° | 120.2° |
C10 | C11 | H111 | H112 | 115.9° | 119.9° |
H101 | C10 | C11 | H111 | 130.1° | 178.6° |
H101 | C10 | C11 | H112 | 20.7° | 61.5° |
H102 | C10 | C11 | H111 | 20.7° | 61.3° |
H102 | C10 | C11 | H112 | 88.8° | 58.6° |
C13 | C12 | H121 | H122 | 118.4° | 120.1° |
C12 | C13 | C14 | H131 | 125.3° | 120.0° |
C12 | C13 | C14 | H132 | 125.2° | 120.0° |
C12 | C13 | H131 | H132 | 118.1° | 120.1° |
C12 | C13 | C14 | O15 | 93.4° | 180.0° |
C12 | C13 | C14 | H141 | 31.8° | 60.0° |
C12 | C13 | C14 | H142 | 141.4° | 60.0° |
H121 | C12 | C13 | C14 | 50.6° | 60.0° |
H121 | C12 | C13 | H131 | 175.9° | 180.0° |
H121 | C12 | C13 | H132 | 74.6° | 59.9° |
H122 | C12 | C13 | C14 | 58.8° | 60.0° |
H122 | C12 | C13 | H131 | 66.5° | 60.0° |
H122 | C12 | C13 | H132 | 176.0° | 179.9° |
C14 | C13 | H131 | H132 | 118.1° | 119.9° |
C13 | C14 | O15 | H141 | 125.3° | 120.0° |
C13 | C14 | O15 | H142 | 125.3° | 120.0° |
C13 | C14 | H141 | H142 | 118.2° | 120.0° |
C13 | C14 | O15 | C16 | 131.9° | 180.0° |
H131 | C13 | C14 | O15 | 141.3° | 60.0° |
H131 | C13 | C14 | H141 | 93.4° | 179.9° |
H131 | C13 | C14 | H142 | 16.1° | 60.0° |
H132 | C13 | C14 | O15 | 31.8° | 60.0° |
H132 | C13 | C14 | H141 | 157.0° | 60.0° |
H132 | C13 | C14 | H142 | 93.4° | 179.9° |
O15 | C14 | H141 | H142 | 118.1° | 120.0° |
C14 | O15 | C16 | C17 | 67.5° | 180.0° |
C14 | O15 | C16 | C21 | 96.3° | 0.0° |
H141 | C14 | O15 | C16 | 102.8° | 60.0° |
H142 | C14 | O15 | C16 | 6.7° | 60.0° |
O15 | C16 | C17 | C21 | 163.4° | 179.9° |
O15 | C16 | C17 | C18 | 162.4° | 180.0° |
O15 | C16 | C17 | H17 | 17.6° | 0.0° |
O15 | C16 | C21 | C20 | 163.1° | 179.7° |
O15 | C16 | C21 | H21 | 17.0° | 0.0° |
C16 | C17 | C18 | H17 | 179.9° | 179.9° |
C16 | C17 | C18 | C19 | 0.0° | 0.1° |
C16 | C17 | C18 | H18 | 180.0° | 180.0° |
C17 | C16 | C21 | C20 | 0.8° | 0.3° |
C17 | C16 | C21 | H21 | 179.2° | 179.9° |
C21 | C16 | C17 | C18 | 0.9° | 0.1° |
C21 | C16 | C17 | H17 | 179.0° | 180.0° |
C16 | C21 | C20 | C19 | 0.3° | 0.6° |
C16 | C21 | C20 | H21 | 180.0° | 179.7° |
C16 | C21 | C20 | H20 | 179.6° | 180.0° |
C17 | C18 | C19 | H18 | 180.0° | 180.0° |
C17 | C18 | C19 | C20 | 1.1° | 0.2° |
C17 | C18 | C19 | C22 | 174.5° | 179.9° |
H17 | C17 | C18 | C19 | 179.9° | 180.0° |
H17 | C17 | C18 | H18 | 0.0° | 0.0° |
C18 | C19 | C20 | C22 | 175.7° | 179.7° |
C18 | C19 | C20 | C21 | 1.3° | 0.6° |
C18 | C19 | C20 | H20 | 178.7° | 180.0° |
C18 | C19 | C22 | O23 | 2.3° | 0.1° |
C18 | C19 | C22 | O24 | 178.0° | 180.0° |
H18 | C18 | C19 | C20 | 178.9° | 179.7° |
H18 | C18 | C19 | C22 | 5.5° | 0.1° |
C19 | C20 | C21 | H20 | 180.0° | 179.5° |
C19 | C20 | C21 | H21 | 179.7° | 179.8° |
C20 | C19 | C22 | O23 | 177.9° | 179.8° |
C20 | C19 | C22 | O24 | 2.4° | 0.3° |
C22 | C19 | C20 | C21 | 174.4° | 179.8° |
C22 | C19 | C20 | H20 | 5.6° | 0.3° |
C19 | C22 | O23 | O24 | 179.7° | 179.9° |
C19 | C22 | O24 | C25 | 112.1° | 179.9° |
H20 | C20 | C21 | H21 | 0.4° | 0.3° |
O23 | C22 | O24 | C25 | 68.2° | 0.0° |
C22 | O24 | C25 | C26 | 57.3° | 180.0° |
C22 | O24 | C25 | H251 | 68.0° | 60.0° |
C22 | O24 | C25 | H252 | 177.5° | 60.0° |
O24 | C25 | C26 | H251 | 125.2° | 120.0° |
O24 | C25 | C26 | H252 | 125.2° | 120.0° |
O24 | C25 | H251 | H252 | 111.4° | 120.0° |
O24 | C25 | C26 | H261 | 180.0° | 180.0° |
O24 | C25 | C26 | H262 | 54.7° | 60.1° |
O24 | C25 | C26 | H263 | 54.7° | 59.9° |
C26 | C25 | H251 | H252 | 111.5° | 120.0° |
C25 | C26 | H261 | H262 | 125.3° | 120.0° |
C25 | C26 | H261 | H263 | 125.3° | 120.1° |
C25 | C26 | H262 | H263 | 111.3° | 120.1° |
H251 | C25 | C26 | H261 | 54.7° | 60.0° |
H251 | C25 | C26 | H262 | 179.9° | 60.0° |
H251 | C25 | C26 | H263 | 70.5° | 180.0° |
H252 | C25 | C26 | H261 | 54.8° | 60.0° |
H252 | C25 | C26 | H262 | 70.5° | 179.9° |
H252 | C25 | C26 | H263 | 179.9° | 60.1° |
H261 | C26 | H262 | H263 | 111.5° | 120.0° |