V0F
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
O14 | C14 | sing | 1.36Å | 1.36Å | |
C08 | C09 | sing | 1.53Å | 1.54Å | |
C08 | C07 | sing | 1.51Å | 1.50Å | |
C14 | C13 | sing | 1.39Å | 1.38Å | Aromatic |
C14 | C15 | doub | 1.39Å | 1.40Å | Aromatic |
C13 | C12A | doub | 1.38Å | 1.39Å | Aromatic |
C09 | C10 | sing | 1.53Å | 1.52Å | |
C10 | C11 | sing | 1.51Å | 1.47Å | |
C07 | O07 | doub | 1.21Å | 1.18Å | |
C07 | C06 | sing | 1.51Å | 1.44Å | |
C12 | C12A | sing | 1.48Å | 1.44Å | |
C12 | C11 | doub | 1.32Å | 1.29Å | |
C15 | C16 | sing | 1.39Å | 1.40Å | Aromatic |
C12A | C16A | sing | 1.42Å | 1.34Å | Aromatic |
C05 | C06 | sing | 1.53Å | 1.50Å | |
C05 | C04 | sing | 1.53Å | 1.52Å | |
C16 | C16A | doub | 1.39Å | 1.38Å | Aromatic |
C16 | O16 | sing | 1.36Å | 1.32Å | |
C16A | C01 | sing | 1.46Å | 1.44Å | |
C19 | C03 | sing | 1.53Å | 1.53Å | |
N2 | C01 | sing | 1.36Å | 1.45Å | |
N2 | C03 | sing | 1.48Å | 1.46Å | |
C01 | O01 | doub | 1.21Å | 1.22Å | |
C04 | C03 | sing | 1.53Å | 1.52Å | |
C03 | H031 | sing | 1.09Å | 1.10Å | |
C04 | H042 | sing | 1.09Å | 1.10Å | |
C04 | H041 | sing | 1.09Å | 1.10Å | |
C05 | H051 | sing | 1.09Å | 1.10Å | |
C05 | H052 | sing | 1.09Å | 1.10Å | |
C06 | H062 | sing | 1.09Å | 1.10Å | |
C06 | H061 | sing | 1.09Å | 1.10Å | |
C08 | H082 | sing | 1.09Å | 1.10Å | |
C08 | H081 | sing | 1.09Å | 1.10Å | |
C09 | H092 | sing | 1.09Å | 1.10Å | |
C09 | H091 | sing | 1.09Å | 1.10Å | |
C10 | H101 | sing | 1.09Å | 1.10Å | |
C10 | H102 | sing | 1.09Å | 1.10Å | |
C11 | H111 | sing | 1.08Å | 1.08Å | |
C12 | H121 | sing | 1.09Å | 1.08Å | |
C13 | H131 | sing | 1.08Å | 1.08Å | |
C15 | H151 | sing | 1.08Å | 1.08Å | |
C19 | H193 | sing | 1.09Å | 1.10Å | |
C19 | H192 | sing | 1.09Å | 1.10Å | |
C19 | H191 | sing | 1.09Å | 1.10Å | |
N2 | H021 | sing | 0.97Å | 1.00Å | |
O14 | H141 | sing | 0.97Å | 0.95Å | |
O16 | H161 | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O14 | C14 | C13 | 119.8° | 119.8° |
O14 | C14 | C15 | 120.4° | 119.9° |
C14 | O14 | H141 | 109.5° | 114.0° |
C09 | C08 | C07 | 106.3° | 109.5° |
C08 | C09 | C10 | 119.7° | 109.8° |
C09 | C08 | H082 | 110.2° | 109.5° |
C09 | C08 | H081 | 110.3° | 109.5° |
C08 | C09 | H092 | 106.9° | 109.5° |
C08 | C09 | H091 | 106.9° | 109.3° |
C08 | C07 | O07 | 124.2° | 120.0° |
C08 | C07 | C06 | 119.6° | 120.0° |
C07 | C08 | H082 | 110.3° | 109.5° |
C07 | C08 | H081 | 110.2° | 109.4° |
C13 | C14 | C15 | 119.8° | 120.2° |
C14 | C13 | C12A | 120.7° | 120.1° |
C14 | C13 | H131 | 119.7° | 119.8° |
C14 | C15 | C16 | 116.7° | 120.3° |
C14 | C15 | H151 | 121.7° | 119.9° |
C13 | C12A | C12 | 112.6° | 121.7° |
C13 | C12A | C16A | 121.7° | 119.8° |
C12A | C13 | H131 | 119.6° | 120.2° |
C09 | C10 | C11 | 124.0° | 109.3° |
C10 | C09 | H092 | 106.9° | 109.6° |
C10 | C09 | H091 | 106.9° | 109.4° |
C09 | C10 | H101 | 105.7° | 109.5° |
C09 | C10 | H102 | 105.7° | 109.6° |
C10 | C11 | C12 | 123.0° | 119.4° |
C11 | C10 | H101 | 105.7° | 109.4° |
C11 | C10 | H102 | 105.7° | 109.5° |
C10 | C11 | H111 | 118.5° | 119.7° |
O07 | C07 | C06 | 115.9° | 120.1° |
C07 | C06 | C05 | 114.4° | 109.6° |
C07 | C06 | H062 | 108.3° | 109.4° |
C07 | C06 | H061 | 108.2° | 109.4° |
C12A | C12 | C11 | 125.4° | 122.4° |
C12 | C12A | C16A | 125.7° | 118.6° |
C12A | C12 | H121 | 117.3° | 118.6° |
C12 | C11 | H111 | 118.5° | 120.9° |
C11 | C12 | H121 | 117.3° | 118.9° |
C15 | C16 | C16A | 123.9° | 120.0° |
C15 | C16 | O16 | 121.5° | 119.4° |
C16 | C15 | H151 | 121.6° | 119.8° |
C12A | C16A | C16 | 117.2° | 119.3° |
C12A | C16A | C01 | 127.2° | 118.4° |
C06 | C05 | C04 | 104.3° | 109.7° |
C06 | C05 | H051 | 110.7° | 109.5° |
C06 | C05 | H052 | 110.7° | 109.4° |
C05 | C06 | H062 | 108.2° | 109.4° |
C05 | C06 | H061 | 108.2° | 109.5° |
C05 | C04 | C03 | 113.6° | 110.3° |
C05 | C04 | H042 | 108.4° | 109.2° |
C05 | C04 | H041 | 108.5° | 109.3° |
C04 | C05 | H051 | 110.8° | 109.5° |
C04 | C05 | H052 | 110.7° | 109.4° |
C16A | C16 | O16 | 114.5° | 120.5° |
C16 | C16A | C01 | 115.1° | 122.2° |
C16 | O16 | H161 | 109.5° | 114.0° |
C16A | C01 | N2 | 114.6° | 121.3° |
C16A | C01 | O01 | 117.6° | 120.3° |
C19 | C03 | N2 | 105.1° | 109.6° |
C19 | C03 | C04 | 100.2° | 109.6° |
C19 | C03 | H031 | 109.7° | 109.5° |
C03 | C19 | H193 | 109.5° | 109.5° |
C03 | C19 | H192 | 109.5° | 109.5° |
C03 | C19 | H191 | 109.5° | 109.4° |
C01 | N2 | C03 | 129.6° | 115.4° |
N2 | C01 | O01 | 126.8° | 118.4° |
C01 | N2 | H021 | 115.2° | 122.6° |
N2 | C03 | C04 | 120.4° | 108.7° |
N2 | C03 | H031 | 110.7° | 109.6° |
C03 | N2 | H021 | 115.2° | 122.0° |
C04 | C03 | H031 | 109.7° | 109.7° |
C03 | C04 | H042 | 108.4° | 109.3° |
C03 | C04 | H041 | 108.4° | 109.5° |
H042 | C04 | H041 | 109.5° | 109.2° |
H051 | C05 | H052 | 109.5° | 109.2° |
H062 | C06 | H061 | 109.4° | 109.5° |
H082 | C08 | H081 | 109.5° | 109.3° |
H092 | C09 | H091 | 109.5° | 109.2° |
H101 | C10 | H102 | 109.5° | 109.5° |
H193 | C19 | H192 | 109.5° | 109.5° |
H193 | C19 | H191 | 109.5° | 109.5° |
H192 | C19 | H191 | 109.4° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O14 | C14 | C13 | C15 | 180.0° | 179.9° |
O14 | C14 | C13 | C12A | 179.6° | 179.4° |
O14 | C14 | C15 | C16 | 178.3° | 178.1° |
O14 | C14 | C13 | H131 | 0.4° | 0.9° |
O14 | C14 | C15 | H151 | 1.7° | 2.0° |
C09 | C08 | C07 | H082 | 119.5° | 120.1° |
C09 | C08 | C07 | H081 | 119.5° | 120.1° |
C08 | C09 | C10 | H092 | 121.5° | 120.3° |
C08 | C09 | C10 | H091 | 121.4° | 119.9° |
C08 | C09 | C10 | C11 | 63.4° | 103.6° |
C09 | C08 | C07 | O07 | 90.7° | 27.8° |
C09 | C08 | C07 | C06 | 82.1° | 152.3° |
C09 | C08 | H082 | H081 | 121.4° | 120.0° |
C08 | C09 | H092 | H091 | 115.4° | 119.7° |
C08 | C09 | C10 | H101 | 174.6° | 136.6° |
C08 | C09 | C10 | H102 | 58.6° | 16.5° |
C07 | C08 | C09 | C10 | 118.0° | 163.3° |
C08 | C07 | O07 | C06 | 173.0° | 179.9° |
C08 | C07 | C06 | C05 | 88.5° | 113.4° |
C08 | C07 | C06 | H062 | 150.7° | 126.7° |
C08 | C07 | C06 | H061 | 32.2° | 6.7° |
C07 | C08 | H082 | H081 | 121.4° | 119.9° |
C07 | C08 | C09 | H092 | 3.5° | 42.9° |
C07 | C08 | C09 | H091 | 120.6° | 76.7° |
C14 | C13 | C12A | H131 | 180.0° | 178.5° |
C14 | C13 | C12A | C12 | 177.8° | 175.9° |
C13 | C14 | C15 | C16 | 1.7° | 1.9° |
C14 | C13 | C12A | C16A | 0.2° | 4.3° |
C13 | C14 | C15 | H151 | 178.4° | 178.1° |
C13 | C14 | O14 | H141 | 180.0° | 89.9° |
C15 | C14 | C13 | C12A | 0.4° | 0.7° |
C14 | C15 | C16 | H151 | 180.0° | 180.0° |
C14 | C15 | C16 | C16A | 3.0° | 0.7° |
C14 | C15 | C16 | O16 | 180.0° | 179.0° |
C15 | C14 | C13 | H131 | 179.6° | 179.2° |
C15 | C14 | O14 | H141 | 0.0° | 90.1° |
C13 | C12A | C12 | C16A | 177.9° | 179.7° |
C13 | C12A | C12 | C11 | 70.2° | 9.6° |
C13 | C12A | C16A | C16 | 1.4° | 5.4° |
C13 | C12A | C16A | C01 | 172.5° | 174.4° |
C13 | C12A | C12 | H121 | 109.8° | 169.1° |
C09 | C10 | C11 | H101 | 122.0° | 119.9° |
C09 | C10 | C11 | H102 | 122.0° | 120.1° |
C09 | C10 | C11 | C12 | 77.3° | 41.3° |
C10 | C09 | C08 | H082 | 1.6° | 76.6° |
C10 | C09 | C08 | H081 | 122.5° | 43.3° |
C10 | C09 | H092 | H091 | 115.4° | 119.8° |
C09 | C10 | H101 | H102 | 113.5° | 120.2° |
C09 | C10 | C11 | H111 | 102.7° | 138.9° |
C10 | C11 | C12 | C12A | 134.3° | 179.8° |
C10 | C11 | C12 | H111 | 180.0° | 179.8° |
C11 | C10 | C09 | H092 | 58.0° | 16.7° |
C11 | C10 | C09 | H091 | 175.1° | 136.5° |
C11 | C10 | H101 | H102 | 113.5° | 120.1° |
C10 | C11 | C12 | H121 | 45.7° | 1.1° |
O07 | C07 | C06 | C05 | 98.1° | 66.8° |
O07 | C07 | C06 | H062 | 22.6° | 53.2° |
O07 | C07 | C06 | H061 | 141.2° | 173.2° |
O07 | C07 | C08 | H082 | 149.8° | 92.3° |
O07 | C07 | C08 | H081 | 28.8° | 147.9° |
C07 | C06 | C05 | H062 | 120.7° | 120.0° |
C07 | C06 | C05 | H061 | 120.7° | 120.1° |
C07 | C06 | C05 | C04 | 166.6° | 112.0° |
C07 | C06 | C05 | H051 | 74.2° | 8.3° |
C07 | C06 | C05 | H052 | 47.4° | 128.0° |
C07 | C06 | H062 | H061 | 117.8° | 119.9° |
C06 | C07 | C08 | H082 | 37.4° | 87.6° |
C06 | C07 | C08 | H081 | 158.4° | 32.3° |
C12A | C12 | C11 | H121 | 180.0° | 178.6° |
C12 | C12A | C16A | C16 | 176.3° | 174.8° |
C12 | C12A | C16A | C01 | 5.2° | 5.3° |
C12A | C12 | C11 | H111 | 45.7° | 0.0° |
C12 | C12A | C13 | H131 | 2.2° | 2.6° |
C11 | C12 | C12A | C16A | 111.9° | 170.2° |
C12 | C11 | C10 | H101 | 160.8° | 161.2° |
C12 | C11 | C10 | H102 | 44.7° | 78.7° |
C15 | C16 | C16A | C12A | 2.9° | 2.9° |
C15 | C16 | C16A | O16 | 177.1° | 179.7° |
C15 | C16 | C16A | C01 | 175.1° | 176.9° |
C15 | C16 | O16 | H161 | 170.1° | 90.0° |
C12A | C16A | C16 | C01 | 172.2° | 179.9° |
C12A | C16A | C16 | O16 | 179.9° | 177.4° |
C12A | C16A | C01 | N2 | 34.0° | 142.4° |
C12A | C16A | C01 | O01 | 156.3° | 36.4° |
C16A | C12A | C12 | H121 | 68.1° | 11.2° |
C16A | C12A | C13 | H131 | 179.8° | 177.2° |
C06 | C05 | C04 | H051 | 119.2° | 120.3° |
C06 | C05 | C04 | H052 | 119.2° | 120.0° |
C06 | C05 | C04 | C03 | 107.2° | 164.2° |
C06 | C05 | C04 | H042 | 132.2° | 75.6° |
C06 | C05 | C04 | H041 | 13.4° | 43.8° |
C06 | C05 | H051 | H052 | 122.4° | 119.8° |
C05 | C06 | H062 | H061 | 117.7° | 120.0° |
C05 | C04 | C03 | C19 | 74.7° | 119.6° |
C05 | C04 | C03 | N2 | 39.7° | 120.6° |
C05 | C04 | C03 | H042 | 120.6° | 120.1° |
C05 | C04 | C03 | H041 | 120.6° | 120.3° |
C05 | C04 | C03 | H031 | 169.9° | 0.7° |
C05 | C04 | H042 | H041 | 118.1° | 119.5° |
C04 | C05 | H051 | H052 | 122.4° | 119.8° |
C04 | C05 | C06 | H062 | 45.9° | 128.0° |
C04 | C05 | C06 | H061 | 72.6° | 8.1° |
C16 | C16A | C01 | N2 | 137.3° | 37.7° |
C16 | C16A | C01 | O01 | 32.4° | 143.4° |
C16A | C16 | C15 | H151 | 177.0° | 179.3° |
C16A | C16 | O16 | H161 | 7.1° | 90.3° |
O16 | C16 | C16A | C01 | 7.8° | 2.8° |
O16 | C16 | C15 | H151 | 0.0° | 1.0° |
C16A | C01 | N2 | O01 | 168.6° | 178.9° |
C16A | C01 | N2 | C03 | 173.2° | 177.8° |
C16A | C01 | N2 | H021 | 6.8° | 2.8° |
C19 | C03 | N2 | C01 | 107.4° | 173.1° |
C19 | C03 | N2 | C04 | 111.9° | 119.8° |
C19 | C03 | N2 | H031 | 118.3° | 120.3° |
C19 | C03 | C04 | H031 | 115.4° | 120.3° |
C19 | C03 | C04 | H042 | 45.9° | 0.5° |
C19 | C03 | C04 | H041 | 164.7° | 120.0° |
C03 | C19 | H193 | H192 | 120.0° | 120.0° |
C03 | C19 | H193 | H191 | 120.0° | 119.9° |
C03 | C19 | H192 | H191 | 120.0° | 120.0° |
C19 | C03 | N2 | H021 | 72.6° | 7.6° |
C01 | N2 | C03 | H021 | 180.0° | 179.3° |
C01 | N2 | C03 | C04 | 140.8° | 67.1° |
C01 | N2 | C03 | H031 | 11.0° | 52.8° |
C03 | N2 | C01 | O01 | 4.6° | 3.3° |
N2 | C03 | C04 | H031 | 130.2° | 119.9° |
N2 | C03 | C04 | H042 | 160.3° | 119.3° |
N2 | C03 | C04 | H041 | 80.9° | 0.2° |
N2 | C03 | C19 | H193 | 180.0° | 179.6° |
N2 | C03 | C19 | H192 | 60.0° | 60.4° |
N2 | C03 | C19 | H191 | 60.0° | 59.6° |
O01 | C01 | N2 | H021 | 175.4° | 176.0° |
C03 | C04 | H042 | H041 | 118.1° | 119.7° |
C03 | C04 | C05 | H051 | 12.0° | 43.9° |
C03 | C04 | C05 | H052 | 133.6° | 75.8° |
C04 | C03 | C19 | H193 | 54.5° | 60.3° |
C04 | C03 | C19 | H192 | 174.5° | 179.7° |
C04 | C03 | C19 | H191 | 65.6° | 59.6° |
C04 | C03 | N2 | H021 | 39.2° | 112.3° |
H031 | C03 | C04 | H042 | 69.4° | 120.8° |
H031 | C03 | C04 | H041 | 49.3° | 119.7° |
H031 | C03 | C19 | H193 | 61.0° | 60.1° |
H031 | C03 | C19 | H192 | 59.1° | 59.9° |
H031 | C03 | C19 | H191 | 179.0° | 180.0° |
H031 | C03 | N2 | H021 | 169.0° | 127.8° |
H042 | C04 | C05 | H051 | 108.6° | 164.1° |
H042 | C04 | C05 | H052 | 13.0° | 44.4° |
H041 | C04 | C05 | H051 | 132.6° | 76.5° |
H041 | C04 | C05 | H052 | 105.7° | 163.8° |
H051 | C05 | C06 | H062 | 165.1° | 111.7° |
H051 | C05 | C06 | H061 | 46.6° | 128.3° |
H052 | C05 | C06 | H062 | 73.3° | 8.0° |
H052 | C05 | C06 | H061 | 168.2° | 112.0° |
H082 | C08 | C09 | H092 | 123.0° | 163.0° |
H082 | C08 | C09 | H091 | 119.9° | 43.4° |
H081 | C08 | C09 | H092 | 116.0° | 77.1° |
H081 | C08 | C09 | H091 | 1.1° | 163.3° |
H092 | C09 | C10 | H101 | 63.9° | 103.1° |
H092 | C09 | C10 | H102 | 180.0° | 136.8° |
H091 | C09 | C10 | H101 | 53.2° | 16.7° |
H091 | C09 | C10 | H102 | 62.9° | 103.5° |
H101 | C10 | C11 | H111 | 19.2° | 19.0° |
H102 | C10 | C11 | H111 | 135.3° | 101.0° |
H111 | C11 | C12 | H121 | 134.3° | 178.6° |
H193 | C19 | H192 | H191 | 120.0° | 120.0° |