QZL
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C12 | C13 | doub | 1.36Å | 1.36Å | Aromatic |
C12 | C11 | sing | 1.40Å | 1.42Å | Aromatic |
C13 | C14 | sing | 1.39Å | 1.39Å | Aromatic |
C10 | C11 | doub | 1.40Å | 1.42Å | Aromatic |
C10 | N3 | sing | 1.31Å | 1.33Å | Aromatic |
C11 | C16 | sing | 1.42Å | 1.43Å | Aromatic |
C14 | C15 | doub | 1.36Å | 1.37Å | Aromatic |
N3 | C9 | doub | 1.33Å | 1.34Å | Aromatic |
C16 | C15 | sing | 1.40Å | 1.42Å | Aromatic |
C16 | C8 | doub | 1.41Å | 1.43Å | Aromatic |
C9 | C8 | sing | 1.38Å | 1.40Å | Aromatic |
C8 | N2 | sing | 1.40Å | 1.41Å | |
N2 | C7 | sing | 1.35Å | 1.36Å | |
O1 | S | doub | 1.42Å | 1.42Å | |
C7 | C6 | sing | 1.51Å | 1.53Å | |
C7 | O2 | doub | 1.21Å | 1.23Å | |
C5 | C6 | sing | 1.53Å | 1.53Å | |
C5 | N1 | sing | 1.47Å | 1.48Å | |
C6 | C17 | sing | 1.51Å | 1.52Å | |
S | N1 | sing | 1.66Å | 1.60Å | |
S | O | doub | 1.42Å | 1.42Å | |
S | N | sing | 1.66Å | 1.60Å | |
N1 | C23 | sing | 1.47Å | 1.47Å | |
C4 | C1 | sing | 1.54Å | 1.52Å | |
C4 | N | sing | 1.47Å | 1.48Å | |
C1 | C | sing | 1.53Å | 1.52Å | |
C1 | C2 | sing | 1.55Å | 1.55Å | |
C17 | C18 | doub | 1.39Å | 1.40Å | Aromatic |
C17 | C22 | sing | 1.38Å | 1.40Å | Aromatic |
N | C3 | sing | 1.47Å | 1.48Å | |
C18 | C19 | sing | 1.38Å | 1.38Å | Aromatic |
C23 | C22 | sing | 1.51Å | 1.51Å | |
C22 | C21 | doub | 1.39Å | 1.39Å | Aromatic |
C2 | C3 | sing | 1.55Å | 1.53Å | |
C19 | CL | sing | 1.74Å | 1.74Å | |
C19 | C20 | doub | 1.38Å | 1.37Å | Aromatic |
C21 | C20 | sing | 1.38Å | 1.38Å | Aromatic |
C4 | H1 | sing | 1.09Å | 1.10Å | |
C4 | H2 | sing | 1.09Å | 1.10Å | |
C5 | H3 | sing | 1.09Å | 1.10Å | |
C5 | H4 | sing | 1.09Å | 1.10Å | |
C6 | H5 | sing | 1.09Å | 1.10Å | |
C10 | H6 | sing | 1.08Å | 1.08Å | |
C13 | H7 | sing | 1.08Å | 1.08Å | |
C15 | H8 | sing | 1.08Å | 1.08Å | |
C20 | H9 | sing | 1.08Å | 1.08Å | |
C21 | H10 | sing | 1.08Å | 1.08Å | |
C18 | H11 | sing | 1.08Å | 1.08Å | |
C23 | H12 | sing | 1.09Å | 1.10Å | |
C23 | H13 | sing | 1.09Å | 1.10Å | |
C3 | H14 | sing | 1.09Å | 1.10Å | |
C3 | H15 | sing | 1.09Å | 1.10Å | |
C2 | H16 | sing | 1.09Å | 1.10Å | |
C2 | H17 | sing | 1.09Å | 1.10Å | |
C1 | H18 | sing | 1.09Å | 1.10Å | |
C | H19 | sing | 1.09Å | 1.10Å | |
C | H20 | sing | 1.09Å | 1.10Å | |
C | H21 | sing | 1.09Å | 1.10Å | |
N2 | H22 | sing | 0.97Å | 1.00Å | |
C14 | H23 | sing | 1.08Å | 1.08Å | |
C12 | H24 | sing | 1.08Å | 1.08Å | |
C9 | H25 | sing | 1.08Å | 1.08Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C13 | C12 | C11 | 120.6° | 119.5° |
C12 | C13 | C14 | 120.6° | 121.1° |
C12 | C13 | H7 | 119.7° | 119.4° |
C13 | C12 | H24 | 119.7° | 120.3° |
C12 | C11 | C10 | 123.1° | 122.0° |
C12 | C11 | C16 | 119.1° | 119.3° |
C11 | C12 | H24 | 119.7° | 120.2° |
C13 | C14 | C15 | 120.6° | 121.0° |
C14 | C13 | H7 | 119.7° | 119.5° |
C13 | C14 | H23 | 119.7° | 119.5° |
C11 | C10 | N3 | 124.1° | 120.2° |
C10 | C11 | C16 | 117.7° | 118.7° |
C11 | C10 | H6 | 118.0° | 119.9° |
C10 | N3 | C9 | 117.6° | 122.9° |
N3 | C10 | H6 | 117.9° | 119.9° |
C11 | C16 | C15 | 118.0° | 119.6° |
C11 | C16 | C8 | 118.1° | 118.2° |
C14 | C15 | C16 | 121.0° | 119.5° |
C14 | C15 | H8 | 119.5° | 120.3° |
C15 | C14 | H23 | 119.7° | 119.5° |
N3 | C9 | C8 | 125.3° | 121.6° |
N3 | C9 | H25 | 117.4° | 119.2° |
C15 | C16 | C8 | 123.9° | 122.2° |
C16 | C15 | H8 | 119.5° | 120.3° |
C16 | C8 | C9 | 117.2° | 118.4° |
C16 | C8 | N2 | 118.7° | 120.8° |
C9 | C8 | N2 | 124.0° | 120.8° |
C8 | C9 | H25 | 117.4° | 119.2° |
C8 | N2 | C7 | 127.5° | 120.0° |
C8 | N2 | H22 | 116.3° | 120.0° |
N2 | C7 | C6 | 114.8° | 120.0° |
N2 | C7 | O2 | 123.1° | 120.0° |
C7 | N2 | H22 | 116.2° | 120.0° |
O1 | S | N1 | 107.9° | 106.4° |
O1 | S | O | 120.8° | 123.1° |
O1 | S | N | 110.8° | 106.4° |
C6 | C7 | O2 | 122.1° | 120.0° |
C7 | C6 | C5 | 111.2° | 109.2° |
C7 | C6 | C17 | 110.5° | 109.2° |
C7 | C6 | H5 | 108.3° | 109.2° |
C6 | C5 | N1 | 112.5° | 107.9° |
C5 | C6 | C17 | 110.0° | 110.8° |
C6 | C5 | H3 | 108.7° | 109.8° |
C6 | C5 | H4 | 108.7° | 109.8° |
C5 | C6 | H5 | 108.4° | 109.2° |
C5 | N1 | S | 118.1° | 121.3° |
C5 | N1 | C23 | 117.0° | 117.4° |
N1 | C5 | H3 | 108.7° | 109.7° |
N1 | C5 | H4 | 108.7° | 109.8° |
C6 | C17 | C18 | 120.8° | 117.6° |
C6 | C17 | C22 | 119.7° | 122.9° |
C17 | C6 | H5 | 108.5° | 109.2° |
N1 | S | O | 107.8° | 106.4° |
N1 | S | N | 100.2° | 107.3° |
S | N1 | C23 | 124.6° | 121.3° |
O | S | N | 107.3° | 106.4° |
S | N | C4 | 122.5° | 125.6° |
S | N | C3 | 122.1° | 125.6° |
N1 | C23 | C22 | 113.8° | 109.6° |
N1 | C23 | H12 | 108.4° | 109.5° |
N1 | C23 | H13 | 108.4° | 109.4° |
C1 | C4 | N | 101.6° | 107.2° |
C4 | C1 | C | 113.5° | 110.7° |
C4 | C1 | C2 | 101.5° | 103.0° |
C1 | C4 | H1 | 111.4° | 109.9° |
C1 | C4 | H2 | 111.4° | 109.9° |
C4 | C1 | H18 | 109.3° | 110.7° |
C4 | N | C3 | 109.0° | 108.7° |
N | C4 | H1 | 111.4° | 109.9° |
N | C4 | H2 | 111.4° | 109.9° |
C | C1 | C2 | 114.1° | 110.7° |
C | C1 | H18 | 109.2° | 110.6° |
C1 | C | H19 | 109.5° | 109.5° |
C1 | C | H20 | 109.5° | 109.4° |
C1 | C | H21 | 109.5° | 109.5° |
C1 | C2 | C3 | 104.9° | 101.6° |
C1 | C2 | H16 | 110.6° | 111.0° |
C1 | C2 | H17 | 110.6° | 111.1° |
C2 | C1 | H18 | 109.0° | 110.9° |
C18 | C17 | C22 | 119.5° | 119.5° |
C17 | C18 | C19 | 119.6° | 120.6° |
C17 | C18 | H11 | 120.2° | 119.7° |
C17 | C22 | C23 | 123.5° | 122.3° |
C17 | C22 | C21 | 119.1° | 119.9° |
N | C3 | C2 | 104.6° | 104.8° |
N | C3 | H14 | 110.6° | 110.3° |
N | C3 | H15 | 110.6° | 110.4° |
C18 | C19 | CL | 119.2° | 120.1° |
C18 | C19 | C20 | 121.6° | 119.8° |
C19 | C18 | H11 | 120.2° | 119.7° |
C23 | C22 | C21 | 117.4° | 117.8° |
C22 | C23 | H12 | 108.4° | 109.4° |
C22 | C23 | H13 | 108.4° | 109.4° |
C22 | C21 | C20 | 121.3° | 120.5° |
C22 | C21 | H10 | 119.3° | 119.7° |
C2 | C3 | H14 | 110.7° | 110.4° |
C2 | C3 | H15 | 110.7° | 110.5° |
C3 | C2 | H16 | 110.6° | 111.0° |
C3 | C2 | H17 | 110.6° | 111.0° |
CL | C19 | C20 | 119.2° | 120.1° |
C19 | C20 | C21 | 118.9° | 119.7° |
C19 | C20 | H9 | 120.5° | 120.2° |
C21 | C20 | H9 | 120.6° | 120.1° |
C20 | C21 | H10 | 119.4° | 119.7° |
H1 | C4 | H2 | 109.5° | 110.0° |
H3 | C5 | H4 | 109.4° | 109.8° |
H12 | C23 | H13 | 109.5° | 109.4° |
H14 | C3 | H15 | 109.5° | 110.3° |
H16 | C2 | H17 | 109.5° | 110.9° |
H19 | C | H20 | 109.5° | 109.4° |
H19 | C | H21 | 109.5° | 109.5° |
H20 | C | H21 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C13 | C12 | C11 | H24 | 180.0° | 179.9° |
C12 | C13 | C14 | H7 | 180.0° | 179.9° |
C13 | C12 | C11 | C10 | 177.1° | 180.0° |
C13 | C12 | C11 | C16 | 1.4° | 0.0° |
C12 | C13 | C14 | C15 | 0.6° | 0.1° |
C12 | C13 | C14 | H23 | 179.4° | 180.0° |
C11 | C12 | C13 | C14 | 0.6° | 0.0° |
C12 | C11 | C10 | C16 | 178.5° | 179.9° |
C12 | C11 | C10 | N3 | 179.3° | 179.9° |
C12 | C11 | C16 | C15 | 1.0° | 0.0° |
C12 | C11 | C16 | C8 | 180.0° | 180.0° |
C12 | C11 | C10 | H6 | 0.7° | 0.0° |
C11 | C12 | C13 | H7 | 179.4° | 179.9° |
C13 | C14 | C15 | H23 | 180.0° | 180.0° |
C13 | C14 | C15 | C16 | 0.9° | 0.1° |
C13 | C14 | C15 | H8 | 179.1° | 180.0° |
C14 | C13 | C12 | H24 | 179.4° | 179.9° |
C11 | C10 | N3 | H6 | 180.0° | 179.9° |
C11 | C10 | N3 | C9 | 0.1° | 0.0° |
C10 | C11 | C16 | C15 | 177.5° | 179.9° |
C10 | C11 | C16 | C8 | 1.4° | 0.0° |
C10 | C11 | C12 | H24 | 2.9° | 0.1° |
N3 | C10 | C11 | C16 | 0.8° | 0.0° |
C10 | N3 | C9 | C8 | 0.5° | 0.0° |
C10 | N3 | C9 | H25 | 179.5° | 179.9° |
C11 | C16 | C15 | C14 | 0.1° | 0.1° |
C11 | C16 | C15 | C8 | 178.9° | 180.0° |
C11 | C16 | C8 | C9 | 1.1° | 0.0° |
C11 | C16 | C8 | N2 | 175.1° | 180.0° |
C16 | C11 | C10 | H6 | 179.1° | 179.9° |
C11 | C16 | C15 | H8 | 179.9° | 180.0° |
C16 | C11 | C12 | H24 | 178.7° | 180.0° |
C14 | C15 | C16 | H8 | 180.0° | 179.9° |
C14 | C15 | C16 | C8 | 178.8° | 180.0° |
C15 | C14 | C13 | H7 | 179.4° | 180.0° |
N3 | C9 | C8 | C16 | 0.2° | 0.0° |
N3 | C9 | C8 | H25 | 180.0° | 180.0° |
N3 | C9 | C8 | N2 | 175.8° | 180.0° |
C9 | N3 | C10 | H6 | 179.9° | 180.0° |
C15 | C16 | C8 | C9 | 177.8° | 179.9° |
C15 | C16 | C8 | N2 | 6.1° | 0.1° |
C16 | C15 | C14 | H23 | 179.1° | 180.0° |
C16 | C8 | C9 | N2 | 176.0° | 180.0° |
C16 | C8 | N2 | C7 | 93.4° | 149.4° |
C8 | C16 | C15 | H8 | 1.2° | 0.1° |
C16 | C8 | N2 | H22 | 86.6° | 30.7° |
C16 | C8 | C9 | H25 | 179.9° | 180.0° |
C9 | C8 | N2 | C7 | 82.5° | 30.6° |
C9 | C8 | N2 | H22 | 97.5° | 149.3° |
C8 | N2 | C7 | H22 | 180.0° | 180.0° |
C8 | N2 | C7 | C6 | 179.6° | 175.5° |
C8 | N2 | C7 | O2 | 0.1° | 4.5° |
N2 | C8 | C9 | H25 | 4.2° | 0.0° |
N2 | C7 | C6 | O2 | 179.7° | 179.9° |
N2 | C7 | C6 | C5 | 79.6° | 92.7° |
N2 | C7 | C6 | C17 | 158.0° | 146.0° |
N2 | C7 | C6 | H5 | 39.3° | 26.6° |
O1 | S | N1 | C5 | 21.3° | 20.4° |
O1 | S | N1 | O | 132.0° | 132.9° |
O1 | S | N1 | N | 116.0° | 113.6° |
O1 | S | O | N | 128.3° | 122.9° |
O1 | S | N1 | C23 | 164.7° | 159.4° |
O1 | S | N | C4 | 26.0° | 151.1° |
O1 | S | N | C3 | 123.0° | 29.0° |
C7 | C6 | C5 | C17 | 122.7° | 120.3° |
C7 | C6 | C5 | H5 | 118.9° | 119.3° |
C7 | C6 | C5 | N1 | 70.3° | 72.9° |
C7 | C6 | C17 | H5 | 118.5° | 119.3° |
C7 | C6 | C17 | C18 | 83.6° | 79.7° |
C7 | C6 | C17 | C22 | 94.0° | 100.1° |
C7 | C6 | C5 | H3 | 50.2° | 167.6° |
C7 | C6 | C5 | H4 | 169.2° | 46.7° |
C6 | C7 | N2 | H22 | 0.4° | 4.5° |
O2 | C7 | C6 | C5 | 100.1° | 87.4° |
O2 | C7 | C6 | C17 | 22.3° | 34.0° |
O2 | C7 | C6 | H5 | 141.0° | 153.3° |
O2 | C7 | N2 | H22 | 179.9° | 175.5° |
C6 | C5 | N1 | H3 | 120.5° | 119.6° |
C6 | C5 | N1 | H4 | 120.5° | 119.6° |
C5 | C6 | C17 | H5 | 118.4° | 120.4° |
C6 | C5 | N1 | S | 132.0° | 115.5° |
C6 | C5 | N1 | C23 | 53.6° | 64.3° |
C5 | C6 | C17 | C18 | 153.3° | 160.0° |
C5 | C6 | C17 | C22 | 29.1° | 20.2° |
C6 | C5 | H3 | H4 | 118.6° | 120.8° |
N1 | C5 | C6 | C17 | 52.4° | 47.5° |
C5 | N1 | S | C23 | 173.9° | 179.8° |
C5 | N1 | S | O | 110.6° | 153.2° |
C5 | N1 | S | N | 137.3° | 93.2° |
C5 | N1 | C23 | C22 | 26.7° | 44.4° |
N1 | C5 | H3 | H4 | 118.6° | 120.8° |
N1 | C5 | C6 | H5 | 170.8° | 167.8° |
C5 | N1 | C23 | H12 | 147.3° | 164.5° |
C5 | N1 | C23 | H13 | 93.9° | 75.6° |
C6 | C17 | C18 | C22 | 177.7° | 179.8° |
C6 | C17 | C18 | C19 | 175.0° | 179.5° |
C6 | C17 | C22 | C23 | 4.4° | 1.5° |
C6 | C17 | C22 | C21 | 175.8° | 179.3° |
C17 | C6 | C5 | H3 | 172.9° | 72.1° |
C17 | C6 | C5 | H4 | 68.1° | 167.1° |
C6 | C17 | C18 | H11 | 5.0° | 0.6° |
N1 | S | O | N | 107.2° | 114.2° |
N1 | S | N | C4 | 87.7° | 95.4° |
N1 | S | N | C3 | 123.3° | 84.5° |
S | N1 | C23 | C22 | 159.3° | 135.4° |
S | N1 | C5 | H3 | 11.5° | 124.9° |
S | N1 | C5 | H4 | 107.5° | 4.1° |
S | N1 | C23 | H12 | 38.7° | 15.3° |
S | N1 | C23 | H13 | 80.1° | 104.6° |
O | S | N1 | C23 | 63.3° | 26.5° |
O | S | N | C4 | 159.8° | 18.2° |
O | S | N | C3 | 10.9° | 161.9° |
N | S | N1 | C23 | 48.7° | 87.0° |
S | N | C4 | C1 | 116.6° | 178.9° |
S | N | C4 | C3 | 152.5° | 179.9° |
S | N | C3 | C2 | 138.6° | 155.8° |
S | N | C4 | H1 | 2.1° | 59.5° |
S | N | C4 | H2 | 124.7° | 61.8° |
S | N | C3 | H14 | 19.4° | 85.4° |
S | N | C3 | H15 | 102.1° | 36.8° |
N1 | C23 | C22 | C17 | 1.9° | 11.6° |
N1 | C23 | C22 | H12 | 120.7° | 120.1° |
N1 | C23 | C22 | H13 | 120.7° | 120.0° |
N1 | C23 | C22 | C21 | 178.3° | 169.2° |
C23 | N1 | C5 | H3 | 174.1° | 55.4° |
C23 | N1 | C5 | H4 | 66.9° | 176.1° |
N1 | C23 | H12 | H13 | 118.1° | 119.9° |
C1 | C4 | N | H1 | 118.7° | 119.4° |
C1 | C4 | N | H2 | 118.7° | 119.4° |
C4 | C1 | C | C2 | 115.6° | 113.5° |
C4 | C1 | C | H18 | 122.3° | 123.0° |
C4 | C1 | C2 | H18 | 115.2° | 118.4° |
C1 | C4 | N | C3 | 35.9° | 1.0° |
C4 | C1 | C2 | C3 | 34.5° | 35.5° |
C1 | C4 | H1 | H2 | 123.6° | 121.1° |
C4 | C1 | C2 | H16 | 84.7° | 153.6° |
C4 | C1 | C2 | H17 | 153.8° | 82.6° |
C4 | C1 | C | H19 | 180.0° | 60.2° |
C4 | C1 | C | H20 | 60.0° | 179.8° |
C4 | C1 | C | H21 | 60.0° | 59.8° |
N | C4 | C1 | C | 165.0° | 140.6° |
N | C4 | C1 | C2 | 42.2° | 22.2° |
C4 | N | C3 | C2 | 14.0° | 24.1° |
N | C4 | H1 | H2 | 123.7° | 121.1° |
C4 | N | C3 | H14 | 133.2° | 94.7° |
C4 | N | C3 | H15 | 105.3° | 143.1° |
N | C4 | C1 | H18 | 72.8° | 96.4° |
C | C1 | C2 | H18 | 122.3° | 123.2° |
C | C1 | C2 | C3 | 157.0° | 153.8° |
C | C1 | C4 | H1 | 76.2° | 21.2° |
C | C1 | C4 | H2 | 46.3° | 100.1° |
C | C1 | C2 | H16 | 37.7° | 88.1° |
C | C1 | C2 | H17 | 83.8° | 35.8° |
C1 | C | H19 | H20 | 120.0° | 119.9° |
C1 | C | H19 | H21 | 120.0° | 120.0° |
C1 | C | H20 | H21 | 120.0° | 120.0° |
C1 | C2 | C3 | N | 13.4° | 37.0° |
C1 | C2 | C3 | H16 | 119.3° | 118.1° |
C1 | C2 | C3 | H17 | 119.3° | 118.1° |
C2 | C1 | C4 | H1 | 161.0° | 97.2° |
C2 | C1 | C4 | H2 | 76.5° | 141.6° |
C1 | C2 | C3 | H14 | 105.9° | 81.8° |
C1 | C2 | C3 | H15 | 132.6° | 155.9° |
C1 | C2 | H16 | H17 | 122.1° | 123.9° |
C2 | C1 | C | H19 | 64.4° | 173.8° |
C2 | C1 | C | H20 | 55.6° | 66.3° |
C2 | C1 | C | H21 | 175.6° | 53.7° |
C17 | C18 | C19 | H11 | 180.0° | 179.9° |
C18 | C17 | C22 | C23 | 177.9° | 178.7° |
C18 | C17 | C22 | C21 | 1.9° | 0.5° |
C17 | C18 | C19 | CL | 177.0° | 179.9° |
C17 | C18 | C19 | C20 | 1.3° | 0.2° |
C18 | C17 | C6 | H5 | 34.9° | 39.6° |
C22 | C17 | C18 | C19 | 2.7° | 0.3° |
C17 | C22 | C23 | C21 | 179.8° | 179.3° |
C17 | C22 | C21 | C20 | 0.3° | 0.4° |
C22 | C17 | C6 | H5 | 147.4° | 140.6° |
C17 | C22 | C21 | H10 | 179.7° | 179.6° |
C22 | C17 | C18 | H11 | 177.3° | 179.6° |
C17 | C22 | C23 | H12 | 122.5° | 131.6° |
C17 | C22 | C23 | H13 | 118.8° | 108.4° |
N | C3 | C2 | H14 | 119.2° | 118.8° |
N | C3 | C2 | H15 | 119.2° | 118.9° |
C3 | N | C4 | H1 | 154.6° | 120.4° |
C3 | N | C4 | H2 | 82.9° | 118.3° |
N | C3 | H14 | H15 | 122.2° | 122.3° |
N | C3 | C2 | H16 | 105.9° | 155.1° |
N | C3 | C2 | H17 | 132.7° | 81.1° |
C18 | C19 | CL | C20 | 178.3° | 179.9° |
C18 | C19 | C20 | C21 | 0.9° | 0.3° |
C18 | C19 | C20 | H9 | 179.1° | 179.7° |
C23 | C22 | C21 | C20 | 179.9° | 178.9° |
C23 | C22 | C21 | H10 | 0.1° | 1.1° |
C22 | C23 | H12 | H13 | 118.0° | 119.9° |
C22 | C21 | C20 | C19 | 1.7° | 0.0° |
C22 | C21 | C20 | H10 | 180.0° | 180.0° |
C22 | C21 | C20 | H9 | 178.3° | 180.0° |
C21 | C22 | C23 | H12 | 57.6° | 49.1° |
C21 | C22 | C23 | H13 | 61.1° | 70.8° |
C2 | C3 | H14 | H15 | 122.3° | 122.4° |
C3 | C2 | H16 | H17 | 122.1° | 123.8° |
C3 | C2 | C1 | H18 | 80.7° | 82.9° |
CL | C19 | C20 | C21 | 179.2° | 179.7° |
CL | C19 | C20 | H9 | 0.8° | 0.2° |
CL | C19 | C18 | H11 | 3.0° | 0.0° |
C19 | C20 | C21 | H9 | 180.0° | 179.9° |
C19 | C20 | C21 | H10 | 178.3° | 180.0° |
C20 | C19 | C18 | H11 | 178.7° | 180.0° |
H1 | C4 | C1 | H18 | 46.0° | 144.2° |
H2 | C4 | C1 | H18 | 168.5° | 23.0° |
H3 | C5 | C6 | H5 | 68.7° | 48.3° |
H4 | C5 | C6 | H5 | 50.4° | 72.5° |
H7 | C13 | C14 | H23 | 0.6° | 0.1° |
H7 | C13 | C12 | H24 | 0.5° | 0.0° |
H8 | C15 | C14 | H23 | 0.9° | 0.0° |
H9 | C20 | C21 | H10 | 1.7° | 0.0° |
H14 | C3 | C2 | H16 | 134.8° | 36.3° |
H14 | C3 | C2 | H17 | 13.4° | 160.1° |
H15 | C3 | C2 | H16 | 13.3° | 86.0° |
H15 | C3 | C2 | H17 | 108.1° | 37.8° |
H16 | C2 | C1 | H18 | 160.0° | 35.2° |
H17 | C2 | C1 | H18 | 38.6° | 159.0° |
H18 | C1 | C | H19 | 57.8° | 62.8° |
H18 | C1 | C | H20 | 177.8° | 57.1° |
H18 | C1 | C | H21 | 62.2° | 177.1° |
H19 | C | H20 | H21 | 120.0° | 120.0° |