ZGX
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C19 | C17 | sing | 1.51Å | 1.53Å | |
C17 | O18 | doub | 1.21Å | 1.18Å | |
C17 | N14 | sing | 1.35Å | 1.47Å | |
C13 | N14 | sing | 1.40Å | 1.43Å | |
C13 | C12 | doub | 1.32Å | 1.55Å | |
N14 | C15 | sing | 1.47Å | 1.43Å | |
C12 | N11 | sing | 1.40Å | 1.51Å | |
C15 | C16 | sing | 1.54Å | 1.54Å | |
N11 | C16 | sing | 1.47Å | 1.50Å | |
C13 | H1 | sing | 1.08Å | 1.08Å | |
C15 | H2 | sing | 1.09Å | 1.10Å | |
C15 | H3 | sing | 1.09Å | 1.10Å | |
N11 | H4 | sing | 0.97Å | 1.00Å | |
C12 | H5 | sing | 1.08Å | 1.08Å | |
C16 | H6 | sing | 1.09Å | 1.10Å | |
C16 | H7 | sing | 1.09Å | 1.10Å | |
C19 | H8 | sing | 1.09Å | 1.10Å | |
C19 | H9 | sing | 1.09Å | 1.10Å | |
C19 | H10 | sing | 1.09Å | 1.10Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C19 | C17 | O18 | 116.6° | 120.0° |
C19 | C17 | N14 | 124.1° | 120.0° |
C17 | C19 | H8 | 109.5° | 109.4° |
C17 | C19 | H9 | 109.5° | 109.4° |
C17 | C19 | H10 | 109.5° | 109.5° |
O18 | C17 | N14 | 119.3° | 120.0° |
C17 | N14 | C13 | 121.6° | 120.5° |
C17 | N14 | C15 | 118.7° | 120.5° |
N14 | C13 | C12 | 120.0° | 120.7° |
C13 | N14 | C15 | 119.6° | 119.0° |
N14 | C13 | H1 | 120.0° | 119.7° |
C13 | C12 | N11 | 119.2° | 120.7° |
C12 | C13 | H1 | 120.0° | 119.6° |
C13 | C12 | H5 | 120.4° | 119.7° |
N14 | C15 | C16 | 119.3° | 107.7° |
N14 | C15 | H2 | 107.0° | 109.9° |
N14 | C15 | H3 | 106.9° | 109.8° |
C12 | N11 | C16 | 110.9° | 119.1° |
C12 | N11 | H4 | 109.1° | 120.5° |
N11 | C12 | H5 | 120.4° | 119.6° |
C15 | C16 | N11 | 117.1° | 107.7° |
C16 | C15 | H2 | 107.0° | 109.8° |
C16 | C15 | H3 | 107.0° | 109.7° |
C15 | C16 | H6 | 107.5° | 109.7° |
C15 | C16 | H7 | 107.5° | 109.8° |
C16 | N11 | H4 | 109.1° | 120.4° |
N11 | C16 | H6 | 107.5° | 109.8° |
N11 | C16 | H7 | 107.5° | 109.8° |
H2 | C15 | H3 | 109.5° | 109.8° |
H6 | C16 | H7 | 109.5° | 109.9° |
H8 | C19 | H9 | 109.5° | 109.5° |
H8 | C19 | H10 | 109.5° | 109.5° |
H9 | C19 | H10 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C19 | C17 | O18 | N14 | 179.5° | 180.0° |
C19 | C17 | N14 | C13 | 2.6° | 0.0° |
C19 | C17 | N14 | C15 | 178.9° | 180.0° |
C17 | C19 | H8 | H9 | 120.0° | 119.9° |
C17 | C19 | H8 | H10 | 120.0° | 120.0° |
C17 | C19 | H9 | H10 | 120.0° | 120.0° |
O18 | C17 | N14 | C13 | 176.8° | 180.0° |
O18 | C17 | N14 | C15 | 0.6° | 0.0° |
O18 | C17 | C19 | H8 | 0.0° | 90.0° |
O18 | C17 | C19 | H9 | 120.0° | 150.0° |
O18 | C17 | C19 | H10 | 120.0° | 30.0° |
C17 | N14 | C13 | C15 | 176.2° | 180.0° |
C17 | N14 | C13 | C12 | 162.4° | 163.6° |
C17 | N14 | C15 | C16 | 177.2° | 136.1° |
C17 | N14 | C13 | H1 | 17.6° | 16.1° |
C17 | N14 | C15 | H2 | 55.8° | 16.5° |
C17 | N14 | C15 | H3 | 61.5° | 104.4° |
N14 | C17 | C19 | H8 | 179.4° | 90.0° |
N14 | C17 | C19 | H9 | 59.4° | 30.0° |
N14 | C17 | C19 | H10 | 60.6° | 150.0° |
N14 | C13 | C12 | H1 | 180.0° | 179.8° |
N14 | C13 | C12 | N11 | 1.2° | 0.3° |
C13 | N14 | C15 | C16 | 0.8° | 43.9° |
C13 | N14 | C15 | H2 | 120.6° | 163.5° |
C13 | N14 | C15 | H3 | 122.2° | 75.6° |
N14 | C13 | C12 | H5 | 178.8° | 179.6° |
C12 | C13 | N14 | C15 | 13.8° | 16.4° |
C13 | C12 | N11 | H5 | 180.0° | 179.9° |
C13 | C12 | N11 | C16 | 29.0° | 16.5° |
C13 | C12 | N11 | H4 | 149.2° | 163.5° |
N14 | C15 | C16 | H2 | 121.4° | 119.6° |
N14 | C15 | C16 | H3 | 121.4° | 119.6° |
N14 | C15 | C16 | N11 | 31.2° | 54.6° |
C15 | N14 | C13 | H1 | 166.1° | 163.9° |
N14 | C15 | H2 | H3 | 115.5° | 120.9° |
N14 | C15 | C16 | H6 | 152.3° | 64.9° |
N14 | C15 | C16 | H7 | 89.9° | 174.2° |
C12 | N11 | C16 | C15 | 43.3° | 44.1° |
C12 | N11 | C16 | H4 | 120.2° | 180.0° |
N11 | C12 | C13 | H1 | 178.8° | 179.9° |
C12 | N11 | C16 | H6 | 164.4° | 75.4° |
C12 | N11 | C16 | H7 | 77.8° | 163.6° |
C15 | C16 | N11 | H6 | 121.1° | 119.5° |
C15 | C16 | N11 | H7 | 121.1° | 119.6° |
C16 | C15 | H2 | H3 | 115.6° | 120.8° |
C15 | C16 | N11 | H4 | 163.5° | 135.9° |
C15 | C16 | H6 | H7 | 116.5° | 120.8° |
N11 | C16 | C15 | H2 | 90.2° | 174.3° |
N11 | C16 | C15 | H3 | 152.6° | 64.9° |
C16 | N11 | C12 | H5 | 151.1° | 163.4° |
N11 | C16 | H6 | H7 | 116.6° | 120.9° |
H1 | C13 | C12 | H5 | 1.1° | 0.1° |
H2 | C15 | C16 | H6 | 30.9° | 54.7° |
H2 | C15 | C16 | H7 | 148.7° | 66.1° |
H3 | C15 | C16 | H6 | 86.3° | 175.5° |
H3 | C15 | C16 | H7 | 31.5° | 54.6° |
H4 | N11 | C12 | H5 | 30.9° | 16.6° |
H4 | N11 | C16 | H6 | 75.4° | 104.6° |
H4 | N11 | C16 | H7 | 42.4° | 16.3° |
H8 | C19 | H9 | H10 | 120.0° | 120.0° |