44C
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C1 | C2 | sing | 1.38Å | 1.38Å | Aromatic |
C1 | C6 | doub | 1.40Å | 1.40Å | Aromatic |
C1 | H1 | sing | 1.08Å | 1.10Å | |
C2 | C3 | doub | 1.40Å | 1.41Å | Aromatic |
C2 | H2 | sing | 1.08Å | 1.10Å | |
C3 | C4 | sing | 1.40Å | 1.42Å | Aromatic |
C3 | C7 | sing | 1.48Å | 1.40Å | Aromatic |
C4 | C5 | doub | 1.38Å | 1.38Å | Aromatic |
C4 | H4 | sing | 1.08Å | 1.10Å | |
C5 | C6 | sing | 1.40Å | 1.39Å | Aromatic |
C5 | H5 | sing | 1.08Å | 1.10Å | |
C6 | C13 | sing | 1.48Å | 1.50Å | |
C7 | C8 | sing | 1.39Å | 1.43Å | Aromatic |
C7 | C12 | doub | 1.39Å | 1.41Å | Aromatic |
C8 | C9 | doub | 1.38Å | 1.38Å | Aromatic |
C8 | H8 | sing | 1.08Å | 1.10Å | |
C9 | C10 | sing | 1.39Å | 1.39Å | Aromatic |
C9 | H9 | sing | 1.08Å | 1.10Å | |
C10 | C11 | doub | 1.39Å | 1.40Å | Aromatic |
C10 | O16 | sing | 1.36Å | 1.43Å | |
C11 | C12 | sing | 1.38Å | 1.38Å | Aromatic |
C11 | H11 | sing | 1.08Å | 1.10Å | |
C12 | H12 | sing | 1.08Å | 1.10Å | |
C13 | O14 | sing | 1.22Å | 1.24Å | |
C13 | O15 | doub | 1.35Å | 1.36Å | |
O14 | H14 | sing | 12.49Å | 0.95Å | |
O16 | C17 | sing | 1.43Å | 1.54Å | |
C17 | C18 | sing | 1.53Å | 1.57Å | |
C17 | H171 | sing | 1.09Å | 1.12Å | |
C17 | H172 | sing | 1.09Å | 1.12Å | |
C18 | C20 | sing | 1.53Å | 1.58Å | |
C18 | H181 | sing | 1.09Å | 1.11Å | |
C18 | H182 | sing | 1.09Å | 1.12Å | |
C19 | C20 | sing | 1.53Å | 1.57Å | |
C19 | O21 | sing | 1.43Å | 1.39Å | |
C19 | H191 | sing | 1.09Å | 1.11Å | |
C19 | H192 | sing | 1.09Å | 1.12Å | |
C20 | H201 | sing | 1.09Å | 1.11Å | |
C20 | H202 | sing | 1.09Å | 1.11Å | |
O21 | C22 | sing | 1.36Å | 1.40Å | |
C22 | C23 | sing | 1.39Å | 1.36Å | Aromatic |
C22 | C27 | doub | 1.39Å | 1.42Å | Aromatic |
C23 | C24 | doub | 1.38Å | 1.40Å | Aromatic |
C23 | H23 | sing | 1.08Å | 1.10Å | |
C24 | C25 | sing | 1.39Å | 1.43Å | Aromatic |
C24 | H24 | sing | 1.08Å | 1.10Å | |
C25 | C26 | doub | 1.39Å | 1.35Å | Aromatic |
C25 | N28 | sing | 1.40Å | 1.46Å | |
C26 | C27 | sing | 1.38Å | 1.40Å | Aromatic |
C26 | H26 | sing | 1.08Å | 1.10Å | |
C27 | H27 | sing | 1.08Å | 1.10Å | |
N28 | C29 | sing | 1.39Å | 1.42Å | |
N28 | H28 | sing | 0.97Å | 1.02Å | |
C29 | C30 | sing | 1.39Å | 1.42Å | Aromatic |
C29 | C34 | doub | 1.40Å | 1.47Å | Aromatic |
C30 | C31 | doub | 1.38Å | 1.35Å | Aromatic |
C30 | H30 | sing | 1.08Å | 1.10Å | |
C31 | C32 | sing | 1.39Å | 1.43Å | Aromatic |
C31 | H31 | sing | 1.08Å | 1.10Å | |
C32 | C33 | doub | 1.38Å | 1.41Å | Aromatic |
C32 | H32 | sing | 1.08Å | 1.10Å | |
C33 | C34 | sing | 1.40Å | 1.36Å | Aromatic |
C33 | H33 | sing | 1.08Å | 1.10Å | |
C34 | C35 | sing | 1.47Å | 1.56Å | |
C35 | O36 | doub | 1.35Å | 1.41Å | |
C35 | O37 | sing | 1.22Å | 1.19Å | |
O37 | H37 | sing | 8.19Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C2 | C1 | C6 | 120.8° | 120.0° |
C2 | C1 | H1 | 118.9° | 120.0° |
C1 | C2 | C3 | 121.2° | 120.0° |
C1 | C2 | H2 | 118.4° | 120.0° |
C6 | C1 | H1 | 120.3° | 120.0° |
C1 | C6 | C5 | 119.2° | 119.9° |
C1 | C6 | C13 | 120.2° | 120.1° |
C3 | C2 | H2 | 120.4° | 120.0° |
C2 | C3 | C4 | 116.9° | 120.0° |
C2 | C3 | C7 | 121.3° | 120.0° |
C4 | C3 | C7 | 121.8° | 120.0° |
C3 | C4 | C5 | 121.8° | 120.1° |
C3 | C4 | H4 | 120.5° | 120.0° |
C3 | C7 | C8 | 122.1° | 120.1° |
C3 | C7 | C12 | 121.1° | 120.0° |
C5 | C4 | H4 | 117.7° | 120.0° |
C4 | C5 | C6 | 120.2° | 120.0° |
C4 | C5 | H5 | 119.7° | 120.0° |
C6 | C5 | H5 | 120.1° | 120.0° |
C5 | C6 | C13 | 120.6° | 120.0° |
C6 | C13 | O14 | 120.8° | 120.0° |
C6 | C13 | O15 | 119.8° | 120.0° |
C8 | C7 | C12 | 116.8° | 119.8° |
C7 | C8 | C9 | 122.1° | 120.0° |
C7 | C8 | H8 | 120.6° | 120.0° |
C7 | C12 | C11 | 120.9° | 120.0° |
C7 | C12 | H12 | 120.5° | 120.1° |
C9 | C8 | H8 | 117.3° | 120.0° |
C8 | C9 | C10 | 119.5° | 120.0° |
C8 | C9 | H9 | 120.0° | 120.0° |
C10 | C9 | H9 | 120.5° | 120.0° |
C9 | C10 | C11 | 119.8° | 120.2° |
C9 | C10 | O16 | 118.8° | 119.9° |
C11 | C10 | O16 | 121.3° | 119.9° |
C10 | C11 | C12 | 120.9° | 120.0° |
C10 | C11 | H11 | 120.1° | 120.0° |
C10 | O16 | C17 | 124.4° | 106.8° |
C12 | C11 | H11 | 119.0° | 120.0° |
C11 | C12 | H12 | 118.6° | 120.0° |
O14 | C13 | O15 | 119.4° | 120.0° |
C13 | O14 | H14 | 120.8° | 60.7° |
O16 | C17 | C18 | 114.6° | 109.5° |
O16 | C17 | H171 | 110.3° | 109.5° |
O16 | C17 | H172 | 110.3° | 109.5° |
C18 | C17 | H171 | 110.4° | 109.4° |
C18 | C17 | H172 | 110.4° | 109.5° |
C17 | C18 | C20 | 114.9° | 109.5° |
C17 | C18 | H181 | 110.2° | 109.5° |
C17 | C18 | H182 | 110.2° | 109.5° |
H171 | C17 | H172 | 99.9° | 109.5° |
C20 | C18 | H181 | 110.2° | 109.5° |
C20 | C18 | H182 | 110.2° | 109.4° |
C18 | C20 | C19 | 117.2° | 109.5° |
C18 | C20 | H201 | 109.4° | 109.5° |
C18 | C20 | H202 | 109.4° | 109.4° |
H181 | C18 | H182 | 100.0° | 109.5° |
C20 | C19 | O21 | 109.8° | 109.5° |
C20 | C19 | H191 | 112.1° | 109.5° |
C20 | C19 | H192 | 112.1° | 109.4° |
C19 | C20 | H201 | 109.4° | 109.5° |
C19 | C20 | H202 | 109.4° | 109.4° |
O21 | C19 | H191 | 112.1° | 109.5° |
O21 | C19 | H192 | 112.1° | 109.5° |
C19 | O21 | C22 | 130.9° | 106.8° |
H191 | C19 | H192 | 98.4° | 109.5° |
H201 | C20 | H202 | 100.8° | 109.5° |
O21 | C22 | C23 | 118.8° | 120.0° |
O21 | C22 | C27 | 123.0° | 120.0° |
C23 | C22 | C27 | 118.2° | 120.0° |
C22 | C23 | C24 | 118.1° | 120.1° |
C22 | C23 | H23 | 119.4° | 120.0° |
C22 | C27 | C26 | 123.7° | 120.0° |
C22 | C27 | H27 | 119.0° | 120.0° |
C24 | C23 | H23 | 122.5° | 120.0° |
C23 | C24 | C25 | 123.4° | 120.0° |
C23 | C24 | H24 | 117.3° | 120.0° |
C25 | C24 | H24 | 119.3° | 120.0° |
C24 | C25 | C26 | 118.4° | 120.0° |
C24 | C25 | N28 | 126.2° | 120.0° |
C26 | C25 | N28 | 115.4° | 120.0° |
C25 | C26 | C27 | 118.2° | 119.9° |
C25 | C26 | H26 | 119.1° | 120.1° |
C25 | N28 | C29 | 136.4° | 120.0° |
C25 | N28 | H28 | 103.0° | 120.0° |
C27 | C26 | H26 | 122.6° | 120.0° |
C26 | C27 | H27 | 117.3° | 120.0° |
C29 | N28 | H28 | 103.0° | 120.0° |
N28 | C29 | C30 | 117.1° | 120.2° |
N28 | C29 | C34 | 120.0° | 120.2° |
C30 | C29 | C34 | 122.8° | 119.6° |
C29 | C30 | C31 | 118.0° | 120.1° |
C29 | C30 | H30 | 123.6° | 119.9° |
C29 | C34 | C33 | 117.7° | 119.6° |
C29 | C34 | C35 | 129.1° | 120.2° |
C31 | C30 | H30 | 118.4° | 120.0° |
C30 | C31 | C32 | 119.4° | 120.4° |
C30 | C31 | H31 | 117.2° | 119.7° |
C32 | C31 | H31 | 123.4° | 119.8° |
C31 | C32 | C33 | 123.7° | 120.4° |
C31 | C32 | H32 | 119.1° | 119.8° |
C33 | C32 | H32 | 117.2° | 119.9° |
C32 | C33 | C34 | 118.3° | 120.0° |
C32 | C33 | H33 | 122.4° | 120.0° |
C34 | C33 | H33 | 119.3° | 120.1° |
C33 | C34 | C35 | 113.2° | 120.2° |
C34 | C35 | O36 | 124.7° | 120.0° |
C34 | C35 | O37 | 118.4° | 120.0° |
O36 | C35 | O37 | 116.9° | 120.0° |
C35 | O37 | H37 | 118.4° | 97.7° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C2 | C1 | C6 | H1 | 180.0° | 179.9° |
C1 | C2 | C3 | H2 | 180.0° | 179.9° |
C1 | C2 | C3 | C4 | 0.1° | 0.1° |
C1 | C2 | C3 | C7 | 179.9° | 180.0° |
C2 | C1 | C6 | C5 | 0.1° | 0.3° |
C2 | C1 | C6 | C13 | 180.0° | 180.0° |
C6 | C1 | C2 | C3 | 0.1° | 0.0° |
C6 | C1 | C2 | H2 | 179.9° | 179.9° |
C1 | C6 | C5 | C4 | 0.1° | 0.6° |
C1 | C6 | C5 | C13 | 180.0° | 179.7° |
C1 | C6 | C5 | H5 | 179.9° | 179.9° |
C1 | C6 | C13 | O14 | 1.1° | 0.0° |
C1 | C6 | C13 | O15 | 179.0° | 180.0° |
H1 | C1 | C2 | C3 | 179.9° | 179.9° |
H1 | C1 | C2 | H2 | 0.0° | 0.0° |
H1 | C1 | C6 | C5 | 180.0° | 179.8° |
H1 | C1 | C6 | C13 | 0.0° | 0.1° |
C2 | C3 | C4 | C7 | 179.8° | 179.9° |
C2 | C3 | C4 | C5 | 0.2° | 0.2° |
C2 | C3 | C4 | H4 | 179.7° | 180.0° |
C2 | C3 | C7 | C8 | 56.1° | 140.2° |
C2 | C3 | C7 | C12 | 123.9° | 40.1° |
H2 | C2 | C3 | C4 | 179.9° | 180.0° |
H2 | C2 | C3 | C7 | 0.1° | 0.1° |
C3 | C4 | C5 | H4 | 180.0° | 179.8° |
C3 | C4 | C5 | C6 | 0.3° | 0.5° |
C3 | C4 | C5 | H5 | 179.7° | 180.0° |
C4 | C3 | C7 | C8 | 124.1° | 39.7° |
C4 | C3 | C7 | C12 | 55.9° | 140.0° |
C7 | C3 | C4 | C5 | 179.9° | 179.7° |
C7 | C3 | C4 | H4 | 0.1° | 0.1° |
C3 | C7 | C8 | C12 | 179.9° | 179.7° |
C3 | C7 | C8 | C9 | 180.0° | 180.0° |
C3 | C7 | C8 | H8 | 0.0° | 0.1° |
C3 | C7 | C12 | C11 | 180.0° | 179.8° |
C3 | C7 | C12 | H12 | 0.1° | 0.2° |
C4 | C5 | C6 | H5 | 180.0° | 179.5° |
C4 | C5 | C6 | C13 | 179.9° | 179.7° |
H4 | C4 | C5 | C6 | 179.7° | 179.7° |
H4 | C4 | C5 | H5 | 0.3° | 0.2° |
C5 | C6 | C13 | O14 | 178.9° | 179.7° |
C5 | C6 | C13 | O15 | 1.0° | 0.3° |
H5 | C5 | C6 | C13 | 0.1° | 0.3° |
C6 | C13 | O14 | O15 | 179.9° | 180.0° |
C6 | C13 | O14 | H14 | 180.0° | 6.7° |
C7 | C8 | C9 | H8 | 180.0° | 180.0° |
C7 | C8 | C9 | C10 | 0.1° | 0.0° |
C7 | C8 | C9 | H9 | 179.9° | 180.0° |
C8 | C7 | C12 | C11 | 0.0° | 0.5° |
C8 | C7 | C12 | H12 | 180.0° | 179.9° |
C12 | C7 | C8 | C9 | 0.1° | 0.3° |
C12 | C7 | C8 | H8 | 179.9° | 179.8° |
C7 | C12 | C11 | C10 | 0.0° | 0.5° |
C7 | C12 | C11 | H12 | 180.0° | 179.6° |
C7 | C12 | C11 | H11 | 180.0° | 179.7° |
C8 | C9 | C10 | H9 | 180.0° | 180.0° |
C8 | C9 | C10 | C11 | 0.1° | 0.0° |
C8 | C9 | C10 | O16 | 178.8° | 180.0° |
H8 | C8 | C9 | C10 | 179.9° | 180.0° |
H8 | C8 | C9 | H9 | 0.1° | 0.0° |
C9 | C10 | C11 | O16 | 178.8° | 179.9° |
C9 | C10 | C11 | C12 | 0.0° | 0.3° |
C9 | C10 | C11 | H11 | 180.0° | 180.0° |
C9 | C10 | O16 | C17 | 165.6° | 180.0° |
H9 | C9 | C10 | C11 | 179.9° | 180.0° |
H9 | C9 | C10 | O16 | 1.3° | 0.1° |
C10 | C11 | C12 | H11 | 180.0° | 179.7° |
C10 | C11 | C12 | H12 | 180.0° | 179.9° |
C11 | C10 | O16 | C17 | 13.2° | 0.1° |
O16 | C10 | C11 | C12 | 178.8° | 179.8° |
O16 | C10 | C11 | H11 | 1.2° | 0.1° |
C10 | O16 | C17 | C18 | 134.2° | 179.9° |
C10 | O16 | C17 | H171 | 100.6° | 60.0° |
C10 | O16 | C17 | H172 | 8.9° | 60.0° |
H11 | C11 | C12 | H12 | 0.0° | 0.2° |
O15 | C13 | O14 | H14 | 0.1° | 173.3° |
O16 | C17 | C18 | H171 | 125.3° | 120.0° |
O16 | C17 | C18 | H172 | 125.3° | 120.0° |
O16 | C17 | H171 | H172 | 116.2° | 120.0° |
O16 | C17 | C18 | C20 | 80.4° | 180.0° |
O16 | C17 | C18 | H181 | 154.4° | 60.0° |
O16 | C17 | C18 | H182 | 44.9° | 60.0° |
C18 | C17 | H171 | H172 | 116.2° | 120.0° |
C17 | C18 | C20 | H181 | 125.3° | 120.0° |
C17 | C18 | C20 | H182 | 125.3° | 120.0° |
C17 | C18 | H181 | H182 | 116.1° | 120.0° |
C17 | C18 | C20 | C19 | 84.8° | 180.0° |
C17 | C18 | C20 | H201 | 150.0° | 60.0° |
C17 | C18 | C20 | H202 | 40.5° | 60.0° |
H171 | C17 | C18 | C20 | 44.9° | 60.0° |
H171 | C17 | C18 | H181 | 80.4° | 180.0° |
H171 | C17 | C18 | H182 | 170.1° | 60.0° |
H172 | C17 | C18 | C20 | 154.4° | 60.0° |
H172 | C17 | C18 | H181 | 29.1° | 60.0° |
H172 | C17 | C18 | H182 | 80.4° | 180.0° |
C20 | C18 | H181 | H182 | 116.1° | 120.0° |
C18 | C20 | C19 | H201 | 125.2° | 120.1° |
C18 | C20 | C19 | H202 | 125.2° | 120.0° |
C18 | C20 | C19 | O21 | 94.7° | 180.0° |
C18 | C20 | C19 | H191 | 140.1° | 59.9° |
C18 | C20 | C19 | H192 | 30.6° | 60.0° |
C18 | C20 | H201 | H202 | 115.1° | 120.0° |
H181 | C18 | C20 | C19 | 40.5° | 59.9° |
H181 | C18 | C20 | H201 | 84.8° | 180.0° |
H181 | C18 | C20 | H202 | 165.7° | 60.0° |
H182 | C18 | C20 | C19 | 150.0° | 60.0° |
H182 | C18 | C20 | H201 | 24.7° | 60.0° |
H182 | C18 | C20 | H202 | 84.8° | 180.0° |
C20 | C19 | O21 | H191 | 125.2° | 120.0° |
C20 | C19 | O21 | H192 | 125.2° | 120.0° |
C20 | C19 | H191 | H192 | 118.0° | 120.0° |
C19 | C20 | H201 | H202 | 115.2° | 120.0° |
C20 | C19 | O21 | C22 | 119.4° | 180.0° |
O21 | C19 | H191 | H192 | 118.0° | 120.0° |
O21 | C19 | C20 | H201 | 30.6° | 60.0° |
O21 | C19 | C20 | H202 | 140.1° | 60.0° |
C19 | O21 | C22 | C23 | 61.2° | 180.0° |
C19 | O21 | C22 | C27 | 120.6° | 0.3° |
H191 | C19 | C20 | H201 | 94.7° | NaN° |
H191 | C19 | C20 | H202 | 14.8° | 60.0° |
H191 | C19 | O21 | C22 | 5.8° | 60.0° |
H192 | C19 | C20 | H201 | 155.8° | 60.0° |
H192 | C19 | C20 | H202 | 94.7° | NaN° |
H192 | C19 | O21 | C22 | 115.3° | 60.0° |
O21 | C22 | C23 | C27 | 178.3° | 179.7° |
O21 | C22 | C23 | C24 | 178.7° | 180.0° |
O21 | C22 | C23 | H23 | 1.2° | 0.0° |
O21 | C22 | C27 | C26 | 178.6° | 179.7° |
O21 | C22 | C27 | H27 | 1.4° | 0.3° |
C22 | C23 | C24 | H23 | 180.0° | 180.0° |
C22 | C23 | C24 | C25 | 0.7° | 0.0° |
C22 | C23 | C24 | H24 | 179.3° | 180.0° |
C23 | C22 | C27 | C26 | 0.4° | 0.6° |
C23 | C22 | C27 | H27 | 179.7° | 180.0° |
C27 | C22 | C23 | C24 | 0.4° | 0.3° |
C27 | C22 | C23 | H23 | 179.5° | 179.7° |
C22 | C27 | C26 | C25 | 0.9° | 0.6° |
C22 | C27 | C26 | H27 | 180.0° | 179.4° |
C22 | C27 | C26 | H26 | 179.1° | 179.7° |
C23 | C24 | C25 | H24 | 180.0° | 179.9° |
C23 | C24 | C25 | C26 | 2.0° | 0.0° |
C23 | C24 | C25 | N28 | 178.2° | 180.0° |
H23 | C23 | C24 | C25 | 179.3° | 180.0° |
H23 | C23 | C24 | H24 | 0.7° | 0.1° |
C24 | C25 | C26 | N28 | 176.6° | 180.0° |
C24 | C25 | C26 | C27 | 2.0° | 0.3° |
C24 | C25 | C26 | H26 | 178.0° | 180.0° |
C24 | C25 | N28 | C29 | 137.4° | 175.9° |
C24 | C25 | N28 | H28 | 12.1° | 4.1° |
H24 | C24 | C25 | C26 | 178.0° | 179.9° |
H24 | C24 | C25 | N28 | 1.8° | 0.1° |
C25 | C26 | C27 | H26 | 180.0° | 179.8° |
C25 | C26 | C27 | H27 | 179.0° | 180.0° |
C26 | C25 | N28 | C29 | 38.9° | 4.1° |
C26 | C25 | N28 | H28 | 164.2° | 175.9° |
N28 | C25 | C26 | C27 | 178.6° | 179.7° |
N28 | C25 | C26 | H26 | 1.4° | 0.0° |
C25 | N28 | C29 | H28 | 125.3° | 180.0° |
C25 | N28 | C29 | C30 | 25.7° | 102.3° |
C25 | N28 | C29 | C34 | 157.0° | 77.4° |
H26 | C26 | C27 | H27 | 0.9° | 0.2° |
N28 | C29 | C30 | C34 | 177.3° | 179.7° |
N28 | C29 | C30 | C31 | 179.8° | 180.0° |
N28 | C29 | C30 | H30 | 0.2° | 0.0° |
N28 | C29 | C34 | C33 | 179.9° | 179.8° |
N28 | C29 | C34 | C35 | 0.3° | 0.2° |
H28 | N28 | C29 | C30 | 99.6° | 77.7° |
H28 | N28 | C29 | C34 | 77.7° | 102.6° |
C29 | C30 | C31 | H30 | 180.0° | 180.0° |
C29 | C30 | C31 | C32 | 0.7° | 0.0° |
C29 | C30 | C31 | H31 | 179.3° | 180.0° |
C30 | C29 | C34 | C33 | 2.9° | 0.5° |
C30 | C29 | C34 | C35 | 176.9° | 179.9° |
C34 | C29 | C30 | C31 | 2.6° | 0.2° |
C34 | C29 | C30 | H30 | 177.4° | 179.7° |
C29 | C34 | C33 | C32 | 1.4° | 0.5° |
C29 | C34 | C33 | C35 | 179.9° | 179.6° |
C29 | C34 | C33 | H33 | 178.6° | 179.7° |
C29 | C34 | C35 | O36 | 178.4° | 174.1° |
C29 | C34 | C35 | O37 | 2.2° | 6.0° |
C30 | C31 | C32 | H31 | 180.0° | 180.0° |
C30 | C31 | C32 | C33 | 0.8° | 0.0° |
C30 | C31 | C32 | H32 | 179.2° | 179.9° |
H30 | C30 | C31 | C32 | 179.3° | 180.0° |
H30 | C30 | C31 | H31 | 0.7° | 0.0° |
C31 | C32 | C33 | H32 | 180.0° | 179.9° |
C31 | C32 | C33 | C34 | 0.4° | 0.2° |
C31 | C32 | C33 | H33 | 179.6° | 180.0° |
H31 | C31 | C32 | C33 | 179.2° | 180.0° |
H31 | C31 | C32 | H32 | 0.8° | 0.1° |
C32 | C33 | C34 | H33 | 180.0° | 179.8° |
C32 | C33 | C34 | C35 | 178.5° | 179.9° |
H32 | C32 | C33 | C34 | 179.6° | 179.9° |
H32 | C32 | C33 | H33 | 0.4° | 0.0° |
C33 | C34 | C35 | O36 | 1.8° | 6.3° |
C33 | C34 | C35 | O37 | 177.7° | 173.6° |
H33 | C33 | C34 | C35 | 1.5° | 0.1° |
C34 | C35 | O36 | O37 | 179.4° | 179.9° |
C34 | C35 | O37 | H37 | 180.0° | 90.5° |
O36 | C35 | O37 | H37 | 0.5° | 89.6° |