P4S
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C16 | C15 | sing | 1.54Å | 1.53Å | |
C16 | C17 | sing | 1.55Å | 1.54Å | |
O4 | C4 | sing | 1.43Å | 1.43Å | |
C15 | C14 | sing | 1.54Å | 1.51Å | |
C15 | O | sing | 1.43Å | 1.43Å | |
C17 | C18 | sing | 1.51Å | 1.50Å | |
C17 | C13 | sing | 1.55Å | 1.55Å | |
C4 | C3 | sing | 1.53Å | 1.53Å | |
C4 | C5 | sing | 1.53Å | 1.52Å | |
C22 | C18 | sing | 1.41Å | 1.40Å | |
C22 | C21 | doub | 1.36Å | 1.39Å | |
C3 | C2 | sing | 1.53Å | 1.53Å | |
C18 | C19 | doub | 1.35Å | 1.40Å | |
C21 | C20 | sing | 1.41Å | 1.40Å | |
C7 | C8 | sing | 1.53Å | 1.52Å | |
C7 | C6 | sing | 1.53Å | 1.53Å | |
C14 | C13 | sing | 1.54Å | 1.52Å | |
C14 | O | sing | 1.43Å | 1.43Å | |
C14 | C9 | sing | 1.52Å | 1.55Å | |
C12 | C13 | sing | 1.53Å | 1.52Å | |
C12 | C11 | sing | 1.53Å | 1.52Å | |
C19 | O1 | sing | 1.34Å | 1.33Å | |
C20 | O1 | sing | 1.34Å | 1.38Å | |
C20 | O2 | doub | 1.22Å | 1.25Å | |
C13 | C23 | sing | 1.53Å | 1.54Å | |
C5 | C6 | sing | 1.53Å | 1.52Å | |
C10 | C9 | sing | 1.53Å | 1.54Å | |
C10 | C11 | sing | 1.53Å | 1.53Å | |
C10 | C1 | sing | 1.53Å | 1.55Å | |
C2 | C1 | sing | 1.53Å | 1.54Å | |
C8 | C9 | sing | 1.53Å | 1.54Å | |
C6 | C1 | sing | 1.53Å | 1.54Å | |
C6 | O3 | sing | 1.43Å | 1.43Å | |
C1 | C | sing | 1.53Å | 1.53Å | |
C2 | H1 | sing | 1.09Å | 1.10Å | |
C2 | H2 | sing | 1.09Å | 1.10Å | |
C3 | H3 | sing | 1.09Å | 1.10Å | |
C3 | H4 | sing | 1.09Å | 1.10Å | |
C4 | H5 | sing | 1.09Å | 1.10Å | |
C5 | H6 | sing | 1.09Å | 1.10Å | |
C5 | H7 | sing | 1.09Å | 1.10Å | |
C7 | H8 | sing | 1.09Å | 1.10Å | |
C7 | H9 | sing | 1.09Å | 1.10Å | |
O3 | H10 | sing | 0.97Å | 0.95Å | |
O4 | H11 | sing | 0.97Å | 0.95Å | |
C19 | H12 | sing | 1.08Å | 1.08Å | |
C21 | H13 | sing | 1.08Å | 1.08Å | |
C22 | H14 | sing | 1.08Å | 1.08Å | |
C17 | H15 | sing | 1.09Å | 1.10Å | |
C23 | H16 | sing | 1.09Å | 1.10Å | |
C23 | H17 | sing | 1.09Å | 1.10Å | |
C23 | H18 | sing | 1.09Å | 1.10Å | |
C12 | H19 | sing | 1.09Å | 1.10Å | |
C12 | H20 | sing | 1.09Å | 1.10Å | |
C11 | H21 | sing | 1.09Å | 1.10Å | |
C11 | H22 | sing | 1.09Å | 1.10Å | |
C10 | H23 | sing | 1.09Å | 1.10Å | |
C | H24 | sing | 1.09Å | 1.10Å | |
C | H25 | sing | 1.09Å | 1.10Å | |
C | H26 | sing | 1.09Å | 1.10Å | |
C16 | H27 | sing | 1.09Å | 1.10Å | |
C16 | H28 | sing | 1.09Å | 1.10Å | |
C15 | H29 | sing | 1.09Å | 1.10Å | |
C9 | H30 | sing | 1.09Å | 1.10Å | |
C8 | H31 | sing | 1.09Å | 1.10Å | |
C8 | H32 | sing | 1.09Å | 1.10Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C15 | C16 | C17 | 106.6° | 104.1° |
C16 | C15 | C14 | 108.3° | 106.1° |
C16 | C15 | O | 115.2° | 118.9° |
C15 | C16 | H27 | 110.2° | 110.5° |
C15 | C16 | H28 | 110.2° | 110.5° |
C16 | C15 | H29 | 119.1° | 117.5° |
C16 | C17 | C18 | 113.4° | 111.6° |
C16 | C17 | C13 | 109.2° | 102.5° |
C16 | C17 | H15 | 106.1° | 110.2° |
C17 | C16 | H27 | 110.2° | 110.5° |
C17 | C16 | H28 | 110.2° | 110.5° |
O4 | C4 | C3 | 111.0° | 109.5° |
O4 | C4 | C5 | 107.6° | 109.5° |
O4 | C4 | H5 | 109.8° | 109.5° |
C4 | O4 | H11 | 109.5° | 114.0° |
C14 | C15 | O | 58.2° | 57.4° |
C15 | C14 | C13 | 110.2° | 107.2° |
C15 | C14 | O | 57.9° | 57.5° |
C15 | C14 | C9 | 128.9° | 121.7° |
C14 | C15 | H29 | 119.4° | 121.6° |
C15 | O | C14 | 63.9° | 65.1° |
O | C15 | H29 | 121.3° | 120.0° |
C18 | C17 | C13 | 114.9° | 110.8° |
C17 | C18 | C22 | 117.7° | 120.0° |
C17 | C18 | C19 | 123.4° | 120.0° |
C18 | C17 | H15 | 106.5° | 110.7° |
C17 | C13 | C14 | 105.5° | 103.8° |
C17 | C13 | C12 | 109.8° | 108.3° |
C17 | C13 | C23 | 116.6° | 111.5° |
C13 | C17 | H15 | 106.0° | 110.8° |
C3 | C4 | C5 | 111.2° | 109.5° |
C4 | C3 | C2 | 113.4° | 109.4° |
C4 | C3 | H3 | 108.5° | 109.5° |
C4 | C3 | H4 | 108.5° | 109.5° |
C3 | C4 | H5 | 108.6° | 109.4° |
C4 | C5 | C6 | 112.6° | 109.5° |
C5 | C4 | H5 | 108.7° | 109.5° |
C4 | C5 | H6 | 108.7° | 109.5° |
C4 | C5 | H7 | 108.7° | 109.4° |
C18 | C22 | C21 | 119.6° | 119.0° |
C22 | C18 | C19 | 119.0° | 119.9° |
C18 | C22 | H14 | 120.2° | 120.5° |
C22 | C21 | C20 | 119.3° | 119.0° |
C22 | C21 | H13 | 120.4° | 120.5° |
C21 | C22 | H14 | 120.2° | 120.5° |
C3 | C2 | C1 | 115.5° | 109.5° |
C3 | C2 | H1 | 107.9° | 109.5° |
C3 | C2 | H2 | 108.0° | 109.5° |
C2 | C3 | H3 | 108.5° | 109.5° |
C2 | C3 | H4 | 108.5° | 109.4° |
C18 | C19 | O1 | 121.2° | 121.0° |
C18 | C19 | H12 | 119.4° | 119.6° |
C21 | C20 | O1 | 120.4° | 120.0° |
C21 | C20 | O2 | 119.2° | 120.0° |
C20 | C21 | H13 | 120.4° | 120.5° |
C8 | C7 | C6 | 111.9° | 109.8° |
C7 | C8 | C9 | 112.5° | 109.1° |
C8 | C7 | H8 | 108.8° | 109.4° |
C8 | C7 | H9 | 108.8° | 109.4° |
C7 | C8 | H31 | 108.7° | 109.5° |
C7 | C8 | H32 | 108.7° | 109.5° |
C7 | C6 | C5 | 108.8° | 109.4° |
C7 | C6 | C1 | 113.2° | 109.7° |
C7 | C6 | O3 | 107.0° | 109.4° |
C6 | C7 | H8 | 108.9° | 109.4° |
C6 | C7 | H9 | 108.9° | 109.5° |
C13 | C14 | O | 112.6° | 118.4° |
C13 | C14 | C9 | 119.5° | 117.2° |
C14 | C13 | C12 | 107.1° | 109.3° |
C14 | C13 | C23 | 108.3° | 112.2° |
O | C14 | C9 | 108.8° | 120.3° |
C14 | C9 | C10 | 109.3° | 109.2° |
C14 | C9 | C8 | 114.6° | 110.8° |
C14 | C9 | H30 | 106.3° | 109.3° |
C13 | C12 | C11 | 113.6° | 110.1° |
C12 | C13 | C23 | 109.1° | 111.4° |
C13 | C12 | H19 | 108.5° | 109.4° |
C13 | C12 | H20 | 108.4° | 109.3° |
C12 | C11 | C10 | 110.6° | 109.4° |
C11 | C12 | H19 | 108.4° | 109.4° |
C11 | C12 | H20 | 108.4° | 109.4° |
C12 | C11 | H21 | 109.2° | 109.5° |
C12 | C11 | H22 | 109.2° | 109.4° |
C19 | O1 | C20 | 120.5° | 121.0° |
O1 | C19 | H12 | 119.4° | 119.5° |
O1 | C20 | O2 | 120.3° | 120.0° |
C13 | C23 | H16 | 109.5° | 109.5° |
C13 | C23 | H17 | 109.5° | 109.5° |
C13 | C23 | H18 | 109.5° | 109.5° |
C5 | C6 | C1 | 113.4° | 109.4° |
C5 | C6 | O3 | 104.0° | 109.5° |
C6 | C5 | H6 | 108.7° | 109.5° |
C6 | C5 | H7 | 108.7° | 109.5° |
C9 | C10 | C11 | 106.3° | 109.1° |
C9 | C10 | C1 | 114.8° | 109.1° |
C10 | C9 | C8 | 113.3° | 109.0° |
C9 | C10 | H23 | 107.1° | 109.5° |
C10 | C9 | H30 | 106.4° | 109.4° |
C11 | C10 | C1 | 114.1° | 110.4° |
C10 | C11 | H21 | 109.2° | 109.5° |
C10 | C11 | H22 | 109.2° | 109.5° |
C11 | C10 | H23 | 107.1° | 109.4° |
C10 | C1 | C2 | 110.2° | 109.6° |
C10 | C1 | C6 | 111.8° | 109.1° |
C10 | C1 | C | 110.3° | 109.5° |
C1 | C10 | H23 | 106.9° | 109.4° |
C2 | C1 | C6 | 110.0° | 109.6° |
C2 | C1 | C | 104.2° | 109.5° |
C1 | C2 | H1 | 108.0° | 109.4° |
C1 | C2 | H2 | 107.9° | 109.5° |
C8 | C9 | H30 | 106.4° | 109.1° |
C9 | C8 | H31 | 108.7° | 109.4° |
C9 | C8 | H32 | 108.7° | 109.7° |
C1 | C6 | O3 | 110.0° | 109.5° |
C6 | C1 | C | 110.0° | 109.5° |
C6 | O3 | H10 | 109.5° | 114.0° |
C1 | C | H24 | 109.5° | 109.4° |
C1 | C | H25 | 109.5° | 109.5° |
C1 | C | H26 | 109.4° | 109.4° |
H1 | C2 | H2 | 109.4° | 109.5° |
H3 | C3 | H4 | 109.5° | 109.6° |
H6 | C5 | H7 | 109.5° | 109.4° |
H8 | C7 | H9 | 109.5° | 109.3° |
H16 | C23 | H17 | 109.5° | 109.5° |
H16 | C23 | H18 | 109.5° | 109.5° |
H17 | C23 | H18 | 109.5° | 109.5° |
H19 | C12 | H20 | 109.5° | 109.3° |
H21 | C11 | H22 | 109.5° | 109.5° |
H24 | C | H25 | 109.5° | 109.5° |
H24 | C | H26 | 109.5° | 109.5° |
H25 | C | H26 | 109.5° | 109.5° |
H27 | C16 | H28 | 109.5° | 110.6° |
H31 | C8 | H32 | 109.4° | 109.6° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C15 | C16 | C17 | H27 | 119.6° | 118.7° |
C15 | C16 | C17 | H28 | 119.5° | 118.6° |
C16 | C15 | C14 | O | 108.8° | 114.3° |
C16 | C15 | C14 | H29 | 140.6° | 138.0° |
C16 | C15 | O | H29 | 156.0° | 158.2° |
C15 | C16 | C17 | C18 | 131.0° | 79.5° |
C15 | C16 | C17 | C13 | 1.4° | 39.0° |
C16 | C15 | C14 | C13 | 4.2° | 1.2° |
C16 | C15 | C14 | C9 | 162.2° | 137.6° |
C15 | C16 | C17 | H15 | 112.4° | 157.0° |
C15 | C16 | H27 | H28 | 121.3° | 122.7° |
C17 | C16 | C15 | C14 | 1.6° | 25.0° |
C17 | C16 | C15 | O | 61.1° | 36.3° |
C16 | C17 | C18 | C13 | 126.7° | 113.5° |
C16 | C17 | C18 | H15 | 116.3° | 123.1° |
C16 | C17 | C13 | H15 | 113.9° | 117.6° |
C16 | C17 | C18 | C22 | 129.1° | 171.7° |
C16 | C17 | C18 | C19 | 51.4° | 8.2° |
C16 | C17 | C13 | C14 | 3.9° | 38.1° |
C16 | C17 | C13 | C12 | 119.0° | 78.0° |
C16 | C17 | C13 | C23 | 116.3° | 159.1° |
C17 | C16 | H27 | H28 | 121.3° | 122.6° |
C17 | C16 | C15 | H29 | 142.4° | 165.0° |
O4 | C4 | C3 | C5 | 119.7° | 120.0° |
O4 | C4 | C3 | H5 | 120.8° | 120.0° |
O4 | C4 | C5 | H5 | 118.9° | 120.0° |
O4 | C4 | C3 | C2 | 118.9° | 60.0° |
O4 | C4 | C5 | C6 | 173.5° | 59.9° |
O4 | C4 | C3 | H3 | 120.5° | 60.0° |
O4 | C4 | C3 | H4 | 1.7° | 179.9° |
O4 | C4 | C5 | H6 | 53.0° | 60.1° |
O4 | C4 | C5 | H7 | 66.0° | 180.0° |
C14 | C15 | O | H29 | 107.4° | 110.5° |
C15 | C14 | C13 | C17 | 4.9° | 23.0° |
C15 | C14 | C13 | O | 62.6° | 61.8° |
C15 | C14 | C13 | C9 | 167.8° | 141.0° |
C15 | C14 | O | C9 | 124.7° | 110.4° |
C15 | C14 | C13 | C12 | 121.8° | 92.3° |
C15 | C14 | C13 | C23 | 120.6° | 143.6° |
C15 | C14 | C9 | C10 | 113.3° | 84.7° |
C15 | C14 | C9 | C8 | 15.1° | 35.3° |
C14 | C15 | C16 | H27 | 121.1° | 93.6° |
C14 | C15 | C16 | H28 | 117.9° | 143.6° |
C15 | C14 | C9 | H30 | 132.3° | 155.6° |
O | C15 | C16 | H27 | 58.4° | 154.9° |
O | C15 | C16 | H28 | 179.3° | 82.3° |
C18 | C17 | C13 | H15 | 117.3° | 123.3° |
C17 | C18 | C22 | C19 | 179.5° | 179.9° |
C17 | C18 | C22 | C21 | 179.5° | 179.9° |
C18 | C17 | C13 | C14 | 132.7° | 81.1° |
C18 | C17 | C13 | C12 | 112.2° | 162.9° |
C17 | C18 | C19 | O1 | 179.3° | 179.9° |
C18 | C17 | C13 | C23 | 12.5° | 40.0° |
C17 | C18 | C19 | H12 | 0.7° | 0.0° |
C17 | C18 | C22 | H14 | 0.5° | 0.0° |
C18 | C17 | C16 | H27 | 11.5° | 161.8° |
C18 | C17 | C16 | H28 | 109.4° | 39.1° |
C13 | C17 | C18 | C22 | 104.2° | 74.7° |
C13 | C17 | C18 | C19 | 75.3° | 105.3° |
C17 | C13 | C14 | C12 | 116.9° | 115.3° |
C17 | C13 | C14 | C23 | 125.5° | 120.6° |
C17 | C13 | C14 | O | 67.6° | 38.8° |
C17 | C13 | C14 | C9 | 162.9° | 164.0° |
C17 | C13 | C12 | C23 | 128.9° | 123.0° |
C17 | C13 | C12 | C11 | 163.7° | 165.7° |
C17 | C13 | C23 | H16 | 180.0° | 61.4° |
C17 | C13 | C23 | H17 | 60.0° | 178.6° |
C17 | C13 | C23 | H18 | 60.0° | 58.6° |
C17 | C13 | C12 | H19 | 75.7° | 74.2° |
C17 | C13 | C12 | H20 | 43.1° | 45.5° |
C13 | C17 | C16 | H27 | 118.1° | 79.6° |
C13 | C17 | C16 | H28 | 121.0° | 157.7° |
C3 | C4 | C5 | H5 | 119.4° | 120.0° |
C4 | C3 | C2 | H3 | 120.6° | 120.0° |
C4 | C3 | C2 | H4 | 120.6° | 119.9° |
C3 | C4 | C5 | C6 | 51.8° | 60.1° |
C4 | C3 | C2 | C1 | 50.7° | 60.0° |
C4 | C3 | C2 | H1 | 171.6° | 60.0° |
C4 | C3 | C2 | H2 | 70.2° | 179.9° |
C4 | C3 | H3 | H4 | 118.2° | 120.1° |
C3 | C4 | C5 | H6 | 68.7° | 179.9° |
C3 | C4 | C5 | H7 | 172.3° | 60.0° |
C3 | C4 | O4 | H11 | 180.0° | 60.0° |
C5 | C4 | C3 | C2 | 0.8° | 60.0° |
C4 | C5 | C6 | C7 | 69.2° | 179.9° |
C4 | C5 | C6 | H6 | 120.5° | 120.0° |
C4 | C5 | C6 | H7 | 120.5° | 120.0° |
C4 | C5 | C6 | C1 | 57.6° | 59.9° |
C4 | C5 | C6 | O3 | 177.0° | 60.0° |
C5 | C4 | C3 | H3 | 119.8° | 180.0° |
C5 | C4 | C3 | H4 | 121.4° | 59.9° |
C4 | C5 | H6 | H7 | 118.5° | 119.9° |
C5 | C4 | O4 | H11 | 58.2° | 180.0° |
C18 | C22 | C21 | H14 | 180.0° | 180.0° |
C18 | C22 | C21 | C20 | 0.1° | 0.0° |
C22 | C18 | C19 | O1 | 0.2° | 0.0° |
C22 | C18 | C19 | H12 | 179.8° | 179.9° |
C18 | C22 | C21 | H13 | 180.0° | 180.0° |
C22 | C18 | C17 | H15 | 12.8° | 48.6° |
C21 | C22 | C18 | C19 | 0.0° | 0.0° |
C22 | C21 | C20 | H13 | 180.0° | 180.0° |
C22 | C21 | C20 | O1 | 0.0° | 0.0° |
C22 | C21 | C20 | O2 | 179.8° | 180.0° |
C3 | C2 | C1 | C10 | 79.0° | 59.8° |
C3 | C2 | C1 | H1 | 120.9° | 120.0° |
C3 | C2 | C1 | H2 | 120.9° | 120.0° |
C3 | C2 | C1 | C6 | 44.8° | 60.0° |
C3 | C2 | C1 | C | 162.7° | 179.9° |
C3 | C2 | H1 | H2 | 117.2° | 120.0° |
C2 | C3 | H3 | H4 | 118.2° | 120.0° |
C2 | C3 | C4 | H5 | 120.3° | 179.9° |
C18 | C19 | O1 | H12 | 180.0° | 180.0° |
C18 | C19 | O1 | C20 | 0.3° | 0.0° |
C19 | C18 | C22 | H14 | 180.0° | 180.0° |
C19 | C18 | C17 | H15 | 167.7° | 131.3° |
C21 | C20 | O1 | C19 | 0.2° | 0.0° |
C21 | C20 | O1 | O2 | 179.7° | 180.0° |
C20 | C21 | C22 | H14 | 179.9° | 180.0° |
C8 | C7 | C6 | H8 | 120.4° | 120.1° |
C8 | C7 | C6 | H9 | 120.3° | 120.1° |
C7 | C8 | C9 | C14 | 124.2° | 179.0° |
C8 | C7 | C6 | C5 | 177.1° | 60.7° |
C7 | C8 | C9 | C10 | 2.2° | 60.8° |
C7 | C8 | C9 | H31 | 120.5° | 119.8° |
C7 | C8 | C9 | H32 | 120.5° | 119.9° |
C8 | C7 | C6 | C1 | 55.9° | 59.3° |
C8 | C7 | C6 | O3 | 65.4° | 179.4° |
C8 | C7 | H8 | H9 | 118.8° | 119.7° |
C7 | C8 | C9 | H30 | 118.7° | 58.6° |
C7 | C8 | H31 | H32 | 118.6° | 120.1° |
C7 | C6 | C5 | C1 | 126.8° | 120.2° |
C7 | C6 | C5 | O3 | 113.8° | 119.9° |
C7 | C6 | C1 | C10 | 6.6° | 59.8° |
C7 | C6 | C1 | C2 | 116.3° | 179.9° |
C6 | C7 | C8 | C9 | 53.3° | 59.7° |
C7 | C6 | C1 | O3 | 119.6° | 120.0° |
C7 | C6 | C1 | C | 129.4° | 60.0° |
C7 | C6 | C5 | H6 | 170.3° | 59.9° |
C7 | C6 | C5 | H7 | 51.2° | 60.1° |
C6 | C7 | H8 | H9 | 118.9° | 119.9° |
C7 | C6 | O3 | H10 | 180.0° | 59.9° |
C6 | C7 | C8 | H31 | 67.2° | 179.5° |
C6 | C7 | C8 | H32 | 173.8° | 60.3° |
C13 | C14 | O | C9 | 134.9° | 156.5° |
C14 | C13 | C12 | C23 | 117.0° | 124.6° |
C14 | C13 | C12 | C11 | 49.6° | 53.2° |
C13 | C14 | C9 | C10 | 51.9° | 50.3° |
C13 | C14 | C9 | C8 | 179.7° | 170.3° |
C14 | C13 | C17 | H15 | 110.1° | 155.6° |
C14 | C13 | C23 | H16 | 61.3° | 177.4° |
C14 | C13 | C23 | H17 | 58.7° | 62.6° |
C14 | C13 | C23 | H18 | 178.7° | 57.4° |
C14 | C13 | C12 | H19 | 170.2° | 173.4° |
C14 | C13 | C12 | H20 | 71.0° | 66.9° |
C13 | C14 | C15 | H29 | 144.8° | 139.2° |
C13 | C14 | C9 | H30 | 62.5° | 69.4° |
O | C14 | C13 | C12 | 175.5° | 154.1° |
O | C14 | C13 | C23 | 58.0° | 81.8° |
O | C14 | C9 | C10 | 176.9° | 153.0° |
O | C14 | C9 | C8 | 48.4° | 32.9° |
O | C14 | C9 | H30 | 68.7° | 87.4° |
C9 | C14 | C13 | C12 | 46.0° | 48.7° |
C9 | C14 | C13 | C23 | 71.6° | 75.4° |
C14 | C9 | C10 | C8 | 129.2° | 121.2° |
C14 | C9 | C10 | H30 | 114.3° | 119.6° |
C14 | C9 | C10 | C11 | 56.4° | 56.3° |
C14 | C9 | C10 | C1 | 176.4° | 177.0° |
C14 | C9 | C8 | H30 | 117.1° | 120.4° |
C14 | C9 | C10 | H23 | 57.9° | 63.3° |
C9 | C14 | C15 | H29 | 21.6° | 0.4° |
C14 | C9 | C8 | H31 | 115.4° | 59.2° |
C14 | C9 | C8 | H32 | 3.7° | 61.1° |
C13 | C12 | C11 | H19 | 120.6° | 120.2° |
C13 | C12 | C11 | H20 | 120.6° | 120.1° |
C13 | C12 | C11 | C10 | 63.0° | 63.8° |
C12 | C13 | C17 | H15 | 5.0° | 39.6° |
C12 | C13 | C23 | H16 | 55.0° | 59.7° |
C12 | C13 | C23 | H17 | 175.0° | 60.3° |
C12 | C13 | C23 | H18 | 65.0° | 179.7° |
C13 | C12 | H19 | H20 | 118.1° | 119.7° |
C13 | C12 | C11 | H21 | 57.1° | 56.2° |
C13 | C12 | C11 | H22 | 176.8° | 176.2° |
C11 | C12 | C13 | C23 | 67.4° | 71.4° |
C12 | C11 | C10 | C9 | 64.1° | 65.0° |
C12 | C11 | C10 | H21 | 120.2° | 120.0° |
C12 | C11 | C10 | H22 | 120.2° | 119.9° |
C12 | C11 | C10 | C1 | 168.3° | 175.1° |
C11 | C12 | H19 | H20 | 118.1° | 119.7° |
C12 | C11 | H21 | H22 | 119.5° | 119.9° |
C12 | C11 | C10 | H23 | 50.2° | 54.7° |
C19 | O1 | C20 | O2 | 179.9° | 180.0° |
C20 | O1 | C19 | H12 | 179.7° | 179.9° |
O1 | C20 | C21 | H13 | 179.9° | 180.0° |
O2 | C20 | C21 | H13 | 0.2° | 0.0° |
C23 | C13 | C17 | H15 | 129.7° | 83.3° |
C13 | C23 | H16 | H17 | 120.0° | 120.0° |
C13 | C23 | H16 | H18 | 120.0° | 120.0° |
C13 | C23 | H17 | H18 | 120.0° | 120.0° |
C23 | C13 | C12 | H19 | 53.2° | 48.8° |
C23 | C13 | C12 | H20 | 171.9° | 168.5° |
C5 | C6 | C1 | C10 | 131.0° | 60.2° |
C5 | C6 | C1 | C2 | 8.1° | 59.9° |
C5 | C6 | C1 | O3 | 115.9° | 120.0° |
C5 | C6 | C1 | C | 106.1° | 180.0° |
C6 | C5 | C4 | H5 | 67.6° | 179.9° |
C6 | C5 | H6 | H7 | 118.6° | 120.0° |
C5 | C6 | C7 | H8 | 62.5° | 179.2° |
C5 | C6 | C7 | H9 | 56.8° | 59.4° |
C5 | C6 | O3 | H10 | 65.0° | 60.0° |
C9 | C10 | C11 | C1 | 127.6° | 119.8° |
C9 | C10 | C11 | H23 | 114.3° | 119.7° |
C9 | C10 | C1 | H23 | 118.7° | 119.7° |
C9 | C10 | C1 | C2 | 167.2° | 178.9° |
C10 | C9 | C8 | H30 | 116.5° | 119.4° |
C9 | C10 | C1 | C6 | 44.5° | 61.1° |
C9 | C10 | C1 | C | 78.2° | 58.7° |
C9 | C10 | C11 | H21 | 56.0° | 55.0° |
C9 | C10 | C11 | H22 | 175.7° | 175.0° |
C10 | C9 | C8 | H31 | 118.2° | 179.4° |
C10 | C9 | C8 | H32 | 122.7° | 59.1° |
C11 | C10 | C1 | H23 | 118.3° | 120.4° |
C11 | C10 | C1 | C2 | 69.7° | 59.0° |
C11 | C10 | C9 | C8 | 174.4° | 177.5° |
C11 | C10 | C1 | C6 | 167.6° | 179.0° |
C11 | C10 | C1 | C | 44.8° | 61.2° |
C10 | C11 | C12 | H19 | 176.4° | 176.0° |
C10 | C11 | C12 | H20 | 57.6° | 56.3° |
C10 | C11 | H21 | H22 | 119.5° | 120.1° |
C11 | C10 | C9 | H30 | 57.9° | 63.3° |
C10 | C1 | C2 | C6 | 123.8° | 119.7° |
C10 | C1 | C2 | C | 118.3° | 120.2° |
C1 | C10 | C9 | C8 | 47.3° | 61.8° |
C10 | C1 | C6 | C | 122.9° | 119.9° |
C10 | C1 | C6 | O3 | 113.1° | 179.9° |
C10 | C1 | C2 | H1 | 41.9° | 179.7° |
C10 | C1 | C2 | H2 | 160.1° | 60.3° |
C1 | C10 | C11 | H21 | 71.5° | 64.9° |
C1 | C10 | C11 | H22 | 48.2° | 55.2° |
C10 | C1 | C | H24 | 180.0° | 179.7° |
C10 | C1 | C | H25 | 60.0° | 59.7° |
C10 | C1 | C | H26 | 60.0° | 60.3° |
C1 | C10 | C9 | H30 | 69.2° | 57.4° |
C2 | C1 | C6 | C | 114.2° | 120.1° |
C2 | C1 | C6 | O3 | 124.1° | 60.1° |
C1 | C2 | H1 | H2 | 117.2° | 120.0° |
C1 | C2 | C3 | H3 | 69.9° | 180.0° |
C1 | C2 | C3 | H4 | 171.3° | 59.9° |
C2 | C1 | C10 | H23 | 48.6° | 61.4° |
C2 | C1 | C | H24 | 61.7° | 60.0° |
C2 | C1 | C | H25 | 178.3° | 179.9° |
C2 | C1 | C | H26 | 58.3° | 60.0° |
C9 | C8 | C7 | H8 | 67.1° | 60.4° |
C9 | C8 | C7 | H9 | 173.7° | 179.9° |
C8 | C9 | C10 | H23 | 71.3° | 57.8° |
C9 | C8 | H31 | H32 | 118.6° | 120.3° |
C6 | C1 | C2 | H1 | 165.7° | 60.0° |
C6 | C1 | C2 | H2 | 76.1° | 180.0° |
C1 | C6 | C5 | H6 | 62.9° | 179.9° |
C1 | C6 | C5 | H7 | 178.0° | 60.1° |
C1 | C6 | C7 | H8 | 64.4° | 60.8° |
C1 | C6 | C7 | H9 | 176.3° | 179.4° |
C1 | C6 | O3 | H10 | 56.7° | 179.9° |
C6 | C1 | C10 | H23 | 74.2° | 58.6° |
C6 | C1 | C | H24 | 56.2° | 60.1° |
C6 | C1 | C | H25 | 63.8° | 59.9° |
C6 | C1 | C | H26 | 176.2° | 179.9° |
O3 | C6 | C1 | C | 9.8° | 60.0° |
O3 | C6 | C5 | H6 | 56.5° | 60.0° |
O3 | C6 | C5 | H7 | 62.6° | 180.0° |
O3 | C6 | C7 | H8 | 174.3° | 59.3° |
O3 | C6 | C7 | H9 | 55.0° | 60.5° |
C | C1 | C2 | H1 | 76.5° | 60.1° |
C | C1 | C2 | H2 | 41.8° | 59.9° |
C | C1 | C10 | H23 | 163.1° | 178.4° |
C1 | C | H24 | H25 | 120.0° | 120.0° |
C1 | C | H24 | H26 | 120.0° | 120.0° |
C1 | C | H25 | H26 | 120.0° | 119.9° |
H1 | C2 | C3 | H3 | 51.0° | 60.0° |
H1 | C2 | C3 | H4 | 67.9° | 179.9° |
H2 | C2 | C3 | H3 | 169.2° | 60.0° |
H2 | C2 | C3 | H4 | 50.4° | 60.2° |
H3 | C3 | C4 | H5 | 0.3° | 60.0° |
H4 | C3 | C4 | H5 | 119.1° | 60.2° |
H5 | C4 | C5 | H6 | 171.9° | 59.9° |
H5 | C4 | C5 | H7 | 52.8° | 60.0° |
H5 | C4 | O4 | H11 | 59.9° | 60.0° |
H8 | C7 | C8 | H31 | 172.4° | 59.3° |
H8 | C7 | C8 | H32 | 53.4° | 179.5° |
H9 | C7 | C8 | H31 | 53.2° | 60.4° |
H9 | C7 | C8 | H32 | 65.9° | 59.8° |
H13 | C21 | C22 | H14 | 0.0° | 0.0° |
H15 | C17 | C16 | H27 | 128.0° | 38.4° |
H15 | C17 | C16 | H28 | 7.1° | 84.4° |
H16 | C23 | H17 | H18 | 120.0° | 120.0° |
H19 | C12 | C11 | H21 | 63.5° | 63.9° |
H19 | C12 | C11 | H22 | 56.2° | 56.0° |
H20 | C12 | C11 | H21 | 177.8° | 176.4° |
H20 | C12 | C11 | H22 | 62.5° | 63.6° |
H21 | C11 | C10 | H23 | 170.3° | 174.7° |
H22 | C11 | C10 | H23 | 70.0° | 65.2° |
H23 | C10 | C9 | H30 | 172.2° | 177.0° |
H24 | C | H25 | H26 | 120.0° | 120.1° |
H27 | C16 | C15 | H29 | 98.1° | 46.4° |
H28 | C16 | C15 | H29 | 22.8° | 76.4° |
H30 | C9 | C8 | H31 | 1.7° | 61.3° |
H30 | C9 | C8 | H32 | 120.8° | 178.5° |