VVS
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C1 | C2 | sing | 1.38Å | 1.40Å | Aromatic |
C1 | C3 | doub | 1.39Å | 1.40Å | Aromatic |
C1 | C4 | sing | 1.51Å | 1.51Å | |
C2 | C5 | doub | 1.38Å | 1.40Å | Aromatic |
C3 | C6 | sing | 1.39Å | 1.40Å | Aromatic |
C3 | O7 | sing | 1.36Å | 1.36Å | |
C4 | N8 | sing | 1.47Å | 1.47Å | |
C5 | C9 | sing | 1.38Å | 1.40Å | Aromatic |
C5 | C10 | sing | 1.51Å | 1.54Å | |
C6 | C9 | doub | 1.38Å | 1.39Å | Aromatic |
C6 | C11 | sing | 1.51Å | 1.51Å | |
N8 | C12 | sing | 1.37Å | 1.37Å | Aromatic |
N8 | C13 | sing | 1.35Å | 1.35Å | Aromatic |
C10 | C14 | sing | 1.53Å | 1.60Å | |
C10 | C15 | sing | 1.53Å | 1.54Å | |
C10 | C16 | sing | 1.53Å | 1.54Å | |
C11 | N17 | sing | 1.46Å | 1.47Å | |
C12 | C18 | doub | 1.35Å | 1.35Å | Aromatic |
C13 | N19 | doub | 1.31Å | 1.31Å | Aromatic |
C14 | C20 | sing | 1.53Å | 1.56Å | |
N17 | C21 | sing | 1.37Å | 1.37Å | Aromatic |
N17 | C22 | sing | 1.35Å | 1.35Å | Aromatic |
C18 | N19 | sing | 1.34Å | 1.37Å | Aromatic |
C20 | C23 | sing | 1.53Å | 1.52Å | |
C20 | C24 | sing | 1.53Å | 1.52Å | |
C20 | C25 | sing | 1.53Å | 1.52Å | |
C21 | C26 | doub | 1.35Å | 1.35Å | Aromatic |
C22 | N27 | doub | 1.31Å | 1.31Å | Aromatic |
C26 | N27 | sing | 1.34Å | 1.37Å | Aromatic |
C2 | H2 | sing | 1.08Å | 1.08Å | |
C4 | H41C | sing | 1.09Å | 1.10Å | |
C4 | H42C | sing | 1.09Å | 1.10Å | |
O7 | H7 | sing | 0.97Å | 0.95Å | |
C9 | H9 | sing | 1.08Å | 1.08Å | |
C11 | H111 | sing | 1.09Å | 1.10Å | |
C11 | H112 | sing | 1.09Å | 1.10Å | |
C12 | H12 | sing | 1.08Å | 1.08Å | |
C13 | H13 | sing | 1.08Å | 1.08Å | |
C14 | H141 | sing | 1.09Å | 1.10Å | |
C14 | H142 | sing | 1.09Å | 1.10Å | |
C15 | H151 | sing | 1.09Å | 1.10Å | |
C15 | H152 | sing | 1.09Å | 1.10Å | |
C15 | H153 | sing | 1.09Å | 1.10Å | |
C16 | H161 | sing | 1.09Å | 1.10Å | |
C16 | H162 | sing | 1.09Å | 1.10Å | |
C16 | H163 | sing | 1.09Å | 1.10Å | |
C18 | H18 | sing | 1.08Å | 1.08Å | |
C21 | H21 | sing | 1.08Å | 1.08Å | |
C22 | H22 | sing | 1.08Å | 1.08Å | |
C23 | H231 | sing | 1.09Å | 1.10Å | |
C23 | H232 | sing | 1.09Å | 1.10Å | |
C23 | H233 | sing | 1.09Å | 1.10Å | |
C24 | H241 | sing | 1.09Å | 1.10Å | |
C24 | H242 | sing | 1.09Å | 1.10Å | |
C24 | H243 | sing | 1.09Å | 1.10Å | |
C25 | H251 | sing | 1.09Å | 1.10Å | |
C25 | H252 | sing | 1.09Å | 1.10Å | |
C25 | H253 | sing | 1.09Å | 1.10Å | |
C26 | H26 | sing | 1.08Å | 1.08Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C2 | C1 | C3 | 118.2° | 120.0° |
C2 | C1 | C4 | 120.7° | 120.0° |
C1 | C2 | C5 | 122.6° | 120.0° |
C1 | C2 | H2 | 118.7° | 120.0° |
C3 | C1 | C4 | 120.7° | 120.0° |
C1 | C3 | C6 | 121.0° | 119.9° |
C1 | C3 | O7 | 120.0° | 120.1° |
C1 | C4 | N8 | 113.7° | 109.5° |
C1 | C4 | H41C | 108.4° | 109.5° |
C1 | C4 | H42C | 108.4° | 109.4° |
C2 | C5 | C9 | 117.2° | 120.1° |
C2 | C5 | C10 | 121.7° | 119.9° |
C5 | C2 | H2 | 118.7° | 120.0° |
C6 | C3 | O7 | 119.0° | 120.1° |
C3 | C6 | C9 | 118.3° | 120.0° |
C3 | C6 | C11 | 120.2° | 120.0° |
C3 | O7 | H7 | 109.5° | 114.0° |
C4 | N8 | C12 | 126.8° | 126.4° |
C4 | N8 | C13 | 126.7° | 126.4° |
N8 | C4 | H41C | 108.4° | 109.5° |
N8 | C4 | H42C | 108.4° | 109.5° |
C9 | C5 | C10 | 121.1° | 120.0° |
C5 | C9 | C6 | 122.7° | 120.0° |
C5 | C9 | H9 | 118.7° | 120.0° |
C5 | C10 | C14 | 113.0° | 109.5° |
C5 | C10 | C15 | 112.0° | 109.5° |
C5 | C10 | C16 | 110.6° | 109.5° |
C9 | C6 | C11 | 121.5° | 120.0° |
C6 | C9 | H9 | 118.7° | 120.0° |
C6 | C11 | N17 | 114.1° | 109.5° |
C6 | C11 | H111 | 108.3° | 109.5° |
C6 | C11 | H112 | 108.3° | 109.5° |
C12 | N8 | C13 | 106.4° | 107.3° |
N8 | C12 | C18 | 105.9° | 106.8° |
N8 | C12 | H12 | 127.0° | 126.6° |
N8 | C13 | N19 | 112.5° | 108.7° |
N8 | C13 | H13 | 123.8° | 125.7° |
C14 | C10 | C15 | 109.2° | 109.5° |
C14 | C10 | C16 | 105.4° | 109.5° |
C10 | C14 | C20 | 131.6° | 109.5° |
C10 | C14 | H141 | 103.7° | 109.5° |
C10 | C14 | H142 | 103.7° | 109.5° |
C15 | C10 | C16 | 106.3° | 109.5° |
C10 | C15 | H151 | 109.5° | 109.5° |
C10 | C15 | H152 | 109.5° | 109.5° |
C10 | C15 | H153 | 109.5° | 109.5° |
C10 | C16 | H161 | 109.5° | 109.5° |
C10 | C16 | H162 | 109.5° | 109.5° |
C10 | C16 | H163 | 109.5° | 109.5° |
C11 | N17 | C21 | 126.7° | 126.4° |
C11 | N17 | C22 | 126.7° | 126.4° |
N17 | C11 | H111 | 108.3° | 109.5° |
N17 | C11 | H112 | 108.3° | 109.5° |
C12 | C18 | N19 | 110.6° | 108.0° |
C18 | C12 | H12 | 127.0° | 126.5° |
C12 | C18 | H18 | 124.7° | 126.0° |
C13 | N19 | C18 | 104.5° | 109.3° |
N19 | C13 | H13 | 123.8° | 125.6° |
C14 | C20 | C23 | 113.3° | 109.5° |
C14 | C20 | C24 | 113.0° | 109.4° |
C14 | C20 | C25 | 104.9° | 109.5° |
C20 | C14 | H141 | 103.7° | 109.5° |
C20 | C14 | H142 | 103.7° | 109.4° |
C21 | N17 | C22 | 106.5° | 107.2° |
N17 | C21 | C26 | 106.0° | 106.8° |
N17 | C21 | H21 | 127.0° | 126.6° |
N17 | C22 | N27 | 112.4° | 108.7° |
N17 | C22 | H22 | 123.8° | 125.6° |
N19 | C18 | H18 | 124.7° | 126.0° |
C23 | C20 | C24 | 108.3° | 109.5° |
C23 | C20 | C25 | 108.7° | 109.5° |
C20 | C23 | H231 | 109.5° | 109.5° |
C20 | C23 | H232 | 109.4° | 109.4° |
C20 | C23 | H233 | 109.4° | 109.4° |
C24 | C20 | C25 | 108.5° | 109.5° |
C20 | C24 | H241 | 109.5° | 109.4° |
C20 | C24 | H242 | 109.4° | 109.4° |
C20 | C24 | H243 | 109.5° | 109.5° |
C20 | C25 | H251 | 109.5° | 109.4° |
C20 | C25 | H252 | 109.5° | 109.5° |
C20 | C25 | H253 | 109.5° | 109.5° |
C21 | C26 | N27 | 110.5° | 108.1° |
C26 | C21 | H21 | 127.0° | 126.6° |
C21 | C26 | H26 | 124.7° | 126.0° |
C22 | N27 | C26 | 104.6° | 109.2° |
N27 | C22 | H22 | 123.8° | 125.7° |
N27 | C26 | H26 | 124.7° | 126.0° |
H41C | C4 | H42C | 109.5° | 109.5° |
H111 | C11 | H112 | 109.5° | 109.4° |
H141 | C14 | H142 | 109.5° | 109.4° |
H151 | C15 | H152 | 109.5° | 109.5° |
H151 | C15 | H153 | 109.4° | 109.4° |
H152 | C15 | H153 | 109.5° | 109.5° |
H161 | C16 | H162 | 109.5° | 109.5° |
H161 | C16 | H163 | 109.4° | 109.4° |
H162 | C16 | H163 | 109.5° | 109.5° |
H231 | C23 | H232 | 109.5° | 109.5° |
H231 | C23 | H233 | 109.5° | 109.5° |
H232 | C23 | H233 | 109.5° | 109.6° |
H241 | C24 | H242 | 109.5° | 109.5° |
H241 | C24 | H243 | 109.4° | 109.5° |
H242 | C24 | H243 | 109.5° | 109.5° |
H251 | C25 | H252 | 109.5° | 109.5° |
H251 | C25 | H253 | 109.5° | 109.5° |
H252 | C25 | H253 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C2 | C1 | C3 | C4 | 173.1° | 179.7° |
C1 | C2 | C5 | H2 | 180.0° | 180.0° |
C2 | C1 | C3 | C6 | 2.3° | 0.0° |
C2 | C1 | C3 | O7 | 176.3° | 180.0° |
C2 | C1 | C4 | N8 | 109.1° | 100.0° |
C1 | C2 | C5 | C9 | 2.6° | 0.1° |
C1 | C2 | C5 | C10 | 179.8° | 180.0° |
C2 | C1 | C4 | H41C | 11.5° | 140.0° |
C2 | C1 | C4 | H42C | 130.2° | 20.0° |
C3 | C1 | C2 | C5 | 3.9° | 0.0° |
C1 | C3 | C6 | O7 | 178.7° | 180.0° |
C3 | C1 | C4 | N8 | 77.9° | 80.3° |
C1 | C3 | C6 | C9 | 0.5° | 0.0° |
C1 | C3 | C6 | C11 | 179.7° | 180.0° |
C3 | C1 | C2 | H2 | 176.1° | 180.0° |
C3 | C1 | C4 | H41C | 161.5° | 39.7° |
C3 | C1 | C4 | H42C | 42.7° | 159.7° |
C1 | C3 | O7 | H7 | 180.0° | 90.0° |
C4 | C1 | C2 | C5 | 177.0° | 179.7° |
C4 | C1 | C3 | C6 | 175.4° | 179.7° |
C4 | C1 | C3 | O7 | 3.2° | 0.3° |
C1 | C4 | N8 | H41C | 120.6° | 120.0° |
C1 | C4 | N8 | H42C | 120.6° | 120.0° |
C1 | C4 | N8 | C12 | 86.6° | 90.0° |
C1 | C4 | N8 | C13 | 96.8° | 90.3° |
C4 | C1 | C2 | H2 | 3.0° | 0.3° |
C1 | C4 | H41C | H42C | 118.1° | 120.0° |
C2 | C5 | C9 | C10 | 177.3° | 179.9° |
C2 | C5 | C9 | C6 | 0.4° | 0.1° |
C2 | C5 | C10 | C14 | 119.5° | 180.0° |
C2 | C5 | C10 | C15 | 4.2° | 60.0° |
C2 | C5 | C10 | C16 | 122.6° | 60.0° |
C2 | C5 | C9 | H9 | 179.6° | 179.9° |
C3 | C6 | C9 | C5 | 1.9° | 0.1° |
C3 | C6 | C9 | C11 | 179.3° | 180.0° |
C3 | C6 | C11 | N17 | 175.2° | 80.0° |
C6 | C3 | O7 | H7 | 1.3° | 90.0° |
C3 | C6 | C9 | H9 | 178.1° | 180.0° |
C3 | C6 | C11 | H111 | 64.1° | 40.0° |
C3 | C6 | C11 | H112 | 54.6° | 160.0° |
O7 | C3 | C6 | C9 | 179.1° | 180.0° |
O7 | C3 | C6 | C11 | 1.6° | 0.0° |
C4 | N8 | C12 | C13 | 177.2° | 179.8° |
C4 | N8 | C12 | C18 | 178.3° | 180.0° |
C4 | N8 | C13 | N19 | 178.4° | 180.0° |
N8 | C4 | H41C | H42C | 118.1° | 120.0° |
C4 | N8 | C12 | H12 | 1.7° | 0.0° |
C4 | N8 | C13 | H13 | 1.6° | 0.0° |
C5 | C9 | C6 | H9 | 180.0° | 180.0° |
C5 | C9 | C6 | C11 | 178.8° | 179.9° |
C9 | C5 | C10 | C14 | 57.7° | 0.1° |
C9 | C5 | C10 | C15 | 178.6° | 119.9° |
C9 | C5 | C10 | C16 | 60.2° | 120.0° |
C9 | C5 | C2 | H2 | 177.5° | 179.9° |
C10 | C5 | C9 | C6 | 176.9° | 180.0° |
C5 | C10 | C14 | C15 | 125.3° | 120.0° |
C5 | C10 | C14 | C16 | 120.9° | 120.0° |
C5 | C10 | C15 | C16 | 120.9° | 120.0° |
C5 | C10 | C14 | C20 | 59.1° | 163.6° |
C10 | C5 | C2 | H2 | 0.2° | 0.0° |
C10 | C5 | C9 | H9 | 3.1° | 0.0° |
C5 | C10 | C14 | H141 | 178.1° | 76.3° |
C5 | C10 | C14 | H142 | 63.7° | 43.6° |
C5 | C10 | C15 | H151 | 180.0° | 57.4° |
C5 | C10 | C15 | H152 | 60.0° | 177.5° |
C5 | C10 | C15 | H153 | 60.0° | 62.5° |
C5 | C10 | C16 | H161 | 180.0° | 69.0° |
C5 | C10 | C16 | H162 | 60.0° | 171.0° |
C5 | C10 | C16 | H163 | 60.0° | 51.0° |
C9 | C6 | C11 | N17 | 5.5° | 100.0° |
C9 | C6 | C11 | H111 | 115.2° | 140.0° |
C9 | C6 | C11 | H112 | 126.2° | 20.0° |
C6 | C11 | N17 | H111 | 120.7° | 120.0° |
C6 | C11 | N17 | H112 | 120.7° | 120.0° |
C6 | C11 | N17 | C21 | 99.1° | 90.0° |
C6 | C11 | N17 | C22 | 83.4° | 90.3° |
C11 | C6 | C9 | H9 | 1.1° | 0.0° |
C6 | C11 | H111 | H112 | 117.9° | 120.0° |
N8 | C12 | C18 | H12 | 180.0° | 180.0° |
C12 | N8 | C13 | N19 | 1.3° | 0.2° |
N8 | C12 | C18 | N19 | 0.7° | 0.2° |
C12 | N8 | C4 | H41C | 34.0° | 30.0° |
C12 | N8 | C4 | H42C | 152.8° | 150.0° |
C12 | N8 | C13 | H13 | 178.7° | 179.7° |
N8 | C12 | C18 | H18 | 179.3° | 180.0° |
C13 | N8 | C12 | C18 | 1.2° | 0.2° |
N8 | C13 | N19 | H13 | 180.0° | 179.9° |
N8 | C13 | N19 | C18 | 0.8° | 0.1° |
C13 | N8 | C4 | H41C | 142.6° | 149.7° |
C13 | N8 | C4 | H42C | 23.8° | 29.7° |
C13 | N8 | C12 | H12 | 178.8° | 179.8° |
C14 | C10 | C15 | C16 | 113.3° | 120.0° |
C10 | C14 | C20 | H141 | 122.8° | 120.1° |
C10 | C14 | C20 | H142 | 122.9° | 120.0° |
C10 | C14 | C20 | C23 | 38.6° | 43.4° |
C10 | C14 | C20 | C24 | 85.1° | 163.3° |
C10 | C14 | C20 | C25 | 156.9° | 76.7° |
C10 | C14 | H141 | H142 | 110.1° | 120.0° |
C14 | C10 | C15 | H151 | 54.2° | 177.4° |
C14 | C10 | C15 | H152 | 65.8° | 62.5° |
C14 | C10 | C15 | H153 | 174.2° | 57.5° |
C14 | C10 | C16 | H161 | 57.6° | 51.0° |
C14 | C10 | C16 | H162 | 177.6° | 69.0° |
C14 | C10 | C16 | H163 | 62.4° | 171.0° |
C15 | C10 | C14 | C20 | 66.1° | 43.6° |
C15 | C10 | C14 | H141 | 56.7° | 163.6° |
C15 | C10 | C14 | H142 | 171.0° | 76.4° |
C10 | C15 | H151 | H152 | 120.0° | 120.1° |
C10 | C15 | H151 | H153 | 120.0° | 120.0° |
C10 | C15 | H152 | H153 | 120.0° | 120.0° |
C15 | C10 | C16 | H161 | 58.3° | 171.0° |
C15 | C10 | C16 | H162 | 61.8° | 51.0° |
C15 | C10 | C16 | H163 | 178.2° | 69.0° |
C16 | C10 | C14 | C20 | 180.0° | 76.4° |
C16 | C10 | C14 | H141 | 57.2° | 43.6° |
C16 | C10 | C14 | H142 | 57.2° | 163.6° |
C16 | C10 | C15 | H151 | 59.1° | 62.6° |
C16 | C10 | C15 | H152 | 179.1° | 57.5° |
C16 | C10 | C15 | H153 | 60.9° | 177.5° |
C10 | C16 | H161 | H162 | 120.0° | 120.0° |
C10 | C16 | H161 | H163 | 120.0° | 120.0° |
C10 | C16 | H162 | H163 | 120.0° | 120.0° |
C11 | N17 | C21 | C22 | 177.9° | 179.7° |
C11 | N17 | C21 | C26 | 179.6° | 180.0° |
C11 | N17 | C22 | N27 | 179.8° | 180.0° |
N17 | C11 | H111 | H112 | 117.9° | 120.0° |
C11 | N17 | C21 | H21 | 0.3° | 0.0° |
C11 | N17 | C22 | H22 | 0.2° | 0.1° |
C12 | C18 | N19 | C13 | 0.0° | 0.0° |
C12 | C18 | N19 | H18 | 180.0° | 179.8° |
C13 | N19 | C18 | H18 | 180.0° | 179.8° |
C14 | C20 | C23 | C24 | 126.2° | 119.9° |
C14 | C20 | C23 | C25 | 116.1° | 120.0° |
C14 | C20 | C24 | C25 | 115.9° | 120.0° |
C20 | C14 | H141 | H142 | 110.1° | 120.0° |
C14 | C20 | C23 | H231 | 180.0° | 57.4° |
C14 | C20 | C23 | H232 | 60.0° | 177.4° |
C14 | C20 | C23 | H233 | 60.0° | 62.5° |
C14 | C20 | C24 | H241 | 180.0° | 60.0° |
C14 | C20 | C24 | H242 | 60.0° | 180.0° |
C14 | C20 | C24 | H243 | 60.0° | 60.0° |
C14 | C20 | C25 | H251 | 180.0° | 69.0° |
C14 | C20 | C25 | H252 | 60.0° | 171.0° |
C14 | C20 | C25 | H253 | 60.0° | 50.9° |
N17 | C21 | C26 | H21 | 180.0° | 180.0° |
C21 | N17 | C22 | N27 | 1.9° | 0.2° |
N17 | C21 | C26 | N27 | 1.1° | 0.2° |
C21 | N17 | C11 | H111 | 21.5° | 30.0° |
C21 | N17 | C11 | H112 | 140.2° | 150.0° |
C21 | N17 | C22 | H22 | 178.1° | 179.8° |
N17 | C21 | C26 | H26 | 178.9° | 180.0° |
C22 | N17 | C21 | C26 | 1.7° | 0.2° |
N17 | C22 | N27 | H22 | 180.0° | 180.0° |
N17 | C22 | N27 | C26 | 1.2° | 0.1° |
C22 | N17 | C11 | H111 | 155.9° | 149.7° |
C22 | N17 | C11 | H112 | 37.3° | 29.7° |
C22 | N17 | C21 | H21 | 178.2° | 179.7° |
N19 | C18 | C12 | H12 | 179.3° | 179.8° |
C18 | N19 | C13 | H13 | 179.2° | 179.8° |
C23 | C20 | C24 | C25 | 117.8° | 120.0° |
C23 | C20 | C14 | H141 | 161.4° | 76.7° |
C23 | C20 | C14 | H142 | 84.3° | 163.3° |
C20 | C23 | H231 | H232 | 120.0° | 120.0° |
C20 | C23 | H231 | H233 | 120.0° | 119.9° |
C20 | C23 | H232 | H233 | 120.0° | 120.0° |
C23 | C20 | C24 | H241 | 53.7° | 180.0° |
C23 | C20 | C24 | H242 | 66.3° | 60.1° |
C23 | C20 | C24 | H243 | 173.6° | 60.0° |
C23 | C20 | C25 | H251 | 58.6° | 51.0° |
C23 | C20 | C25 | H252 | 178.6° | 69.0° |
C23 | C20 | C25 | H253 | 61.4° | 170.9° |
C24 | C20 | C14 | H141 | 37.7° | 43.3° |
C24 | C20 | C14 | H142 | 152.1° | 76.7° |
C24 | C20 | C23 | H231 | 53.8° | 62.5° |
C24 | C20 | C23 | H232 | 173.8° | 57.5° |
C24 | C20 | C23 | H233 | 66.2° | 177.5° |
C20 | C24 | H241 | H242 | 120.0° | 119.9° |
C20 | C24 | H241 | H243 | 120.0° | 120.0° |
C20 | C24 | H242 | H243 | 120.0° | 120.0° |
C24 | C20 | C25 | H251 | 59.0° | 171.0° |
C24 | C20 | C25 | H252 | 61.0° | 51.0° |
C24 | C20 | C25 | H253 | 179.0° | 69.1° |
C25 | C20 | C14 | H141 | 80.3° | 163.3° |
C25 | C20 | C14 | H142 | 34.1° | 43.3° |
C25 | C20 | C23 | H231 | 63.9° | 177.5° |
C25 | C20 | C23 | H232 | 56.1° | 62.5° |
C25 | C20 | C23 | H233 | 176.1° | 57.5° |
C25 | C20 | C24 | H241 | 64.1° | 60.0° |
C25 | C20 | C24 | H242 | 175.9° | 60.0° |
C25 | C20 | C24 | H243 | 55.8° | 180.0° |
C20 | C25 | H251 | H252 | 120.0° | 120.0° |
C20 | C25 | H251 | H253 | 120.0° | 120.0° |
C20 | C25 | H252 | H253 | 120.0° | 120.0° |
C21 | C26 | N27 | C22 | 0.0° | 0.0° |
C21 | C26 | N27 | H26 | 180.0° | 179.9° |
C22 | N27 | C26 | H26 | 180.0° | 179.9° |
N27 | C26 | C21 | H21 | 178.9° | 179.8° |
C26 | N27 | C22 | H22 | 178.8° | 179.9° |
H12 | C12 | C18 | H18 | 0.7° | 0.0° |
H151 | C15 | H152 | H153 | 120.0° | 119.9° |
H161 | C16 | H162 | H163 | 120.0° | 119.9° |
H21 | C21 | C26 | H26 | 1.1° | 0.1° |
H231 | C23 | H232 | H233 | 120.0° | 120.1° |
H241 | C24 | H242 | H243 | 119.9° | 120.1° |
H251 | C25 | H252 | H253 | 120.0° | 120.0° |