W7V
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C10 | C09 | sing | 1.55Å | 1.63Å | |
| C10 | C05 | sing | 1.54Å | 1.59Å | |
| C01 | N02 | sing | 1.47Å | 1.47Å | |
| O04 | C03 | doub | 1.21Å | 1.19Å | |
| C09 | C08 | sing | 1.55Å | 1.44Å | |
| N02 | C03 | sing | 1.35Å | 1.48Å | |
| N02 | C11 | sing | 1.41Å | 1.46Å | |
| C03 | C05 | sing | 1.51Å | 1.55Å | |
| C12 | C11 | sing | 1.40Å | 1.39Å | Aromatic |
| C12 | N13 | doub | 1.31Å | 1.34Å | Aromatic |
| C11 | C15 | doub | 1.36Å | 1.37Å | Aromatic |
| C05 | C06 | sing | 1.53Å | 1.47Å | |
| C05 | C07 | sing | 1.54Å | 1.50Å | |
| N13 | N14 | sing | 1.40Å | 1.37Å | Aromatic |
| C15 | N14 | sing | 1.36Å | 1.32Å | Aromatic |
| C08 | C07 | sing | 1.54Å | 1.63Å | |
| C06 | C07 | sing | 1.56Å | 1.46Å | |
| C10 | H102 | sing | 1.09Å | 1.10Å | |
| C10 | H101 | sing | 1.09Å | 1.10Å | |
| C15 | H151 | sing | 1.08Å | 1.08Å | |
| C01 | H012 | sing | 1.09Å | 1.10Å | |
| C01 | H013 | sing | 1.09Å | 1.10Å | |
| C01 | H011 | sing | 1.09Å | 1.10Å | |
| C06 | H061 | sing | 1.09Å | 1.10Å | |
| C06 | H062 | sing | 1.09Å | 1.10Å | |
| C07 | H071 | sing | 1.09Å | 1.10Å | |
| C08 | H082 | sing | 1.09Å | 1.10Å | |
| C08 | H081 | sing | 1.09Å | 1.10Å | |
| C09 | H091 | sing | 1.09Å | 1.10Å | |
| C09 | H092 | sing | 1.09Å | 1.10Å | |
| C12 | H121 | sing | 1.08Å | 1.08Å | |
| N14 | H141 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C09 | C10 | C05 | 103.4° | 104.1° |
| C10 | C09 | C08 | 103.5° | 102.8° |
| C09 | C10 | H102 | 111.0° | 110.5° |
| C09 | C10 | H101 | 111.0° | 110.5° |
| C10 | C09 | H091 | 110.9° | 110.7° |
| C10 | C09 | H092 | 110.9° | 110.8° |
| C10 | C05 | C03 | 102.1° | 117.3° |
| C10 | C05 | C06 | 163.3° | 118.2° |
| C10 | C05 | C07 | 107.7° | 106.6° |
| C05 | C10 | H102 | 111.0° | 110.5° |
| C05 | C10 | H101 | 111.0° | 110.5° |
| C01 | N02 | C03 | 117.9° | 120.0° |
| C01 | N02 | C11 | 115.5° | 120.0° |
| N02 | C01 | H012 | 109.5° | 109.5° |
| N02 | C01 | H013 | 109.5° | 109.5° |
| N02 | C01 | H011 | 109.5° | 109.5° |
| O04 | C03 | N02 | 116.5° | 120.0° |
| O04 | C03 | C05 | 114.7° | 120.0° |
| C09 | C08 | C07 | 107.9° | 104.2° |
| C09 | C08 | H082 | 109.9° | 110.5° |
| C09 | C08 | H081 | 109.8° | 110.6° |
| C08 | C09 | H091 | 110.9° | 110.8° |
| C08 | C09 | H092 | 110.9° | 110.8° |
| C03 | N02 | C11 | 126.4° | 120.0° |
| N02 | C03 | C05 | 128.5° | 120.0° |
| N02 | C11 | C12 | 123.7° | 126.1° |
| N02 | C11 | C15 | 129.1° | 126.1° |
| C03 | C05 | C06 | 94.7° | 119.4° |
| C03 | C05 | C07 | 131.6° | 121.4° |
| C11 | C12 | N13 | 107.0° | 108.4° |
| C12 | C11 | C15 | 107.2° | 107.8° |
| C11 | C12 | H121 | 126.5° | 125.8° |
| C12 | N13 | N14 | 108.3° | 108.3° |
| N13 | C12 | H121 | 126.5° | 125.8° |
| C11 | C15 | N14 | 108.3° | 107.6° |
| C11 | C15 | H151 | 125.9° | 126.2° |
| C06 | C05 | C07 | 59.1° | 60.9° |
| C05 | C06 | C07 | 61.6° | 59.8° |
| C05 | C06 | H061 | 119.8° | 117.4° |
| C05 | C06 | H062 | 119.8° | 117.5° |
| C05 | C07 | C08 | 105.4° | 106.6° |
| C05 | C07 | C06 | 59.4° | 59.3° |
| C05 | C07 | H071 | 96.8° | 121.3° |
| N13 | N14 | C15 | 109.2° | 107.9° |
| N13 | N14 | H141 | 125.4° | 126.0° |
| N14 | C15 | H151 | 125.8° | 126.2° |
| C15 | N14 | H141 | 125.4° | 126.1° |
| C08 | C07 | C06 | 160.9° | 118.3° |
| C08 | C07 | H071 | 96.3° | 117.8° |
| C07 | C08 | H082 | 109.9° | 110.5° |
| C07 | C08 | H081 | 109.9° | 110.5° |
| C07 | C06 | H061 | 119.8° | 117.2° |
| C07 | C06 | H062 | 119.7° | 118.1° |
| C06 | C07 | H071 | 97.0° | 119.4° |
| H102 | C10 | H101 | 109.5° | 110.5° |
| H012 | C01 | H013 | 109.5° | 109.5° |
| H012 | C01 | H011 | 109.4° | 109.5° |
| H013 | C01 | H011 | 109.5° | 109.5° |
| H061 | C06 | H062 | 109.4° | 115.5° |
| H082 | C08 | H081 | 109.5° | 110.4° |
| H091 | C09 | H092 | 109.5° | 110.8° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C09 | C10 | C05 | H102 | 119.0° | 118.7° |
| C09 | C10 | C05 | H101 | 119.1° | 118.7° |
| C10 | C09 | C08 | H091 | 119.0° | 118.2° |
| C10 | C09 | C08 | H092 | 119.0° | 118.3° |
| C09 | C10 | C05 | C03 | 161.7° | 116.4° |
| C09 | C10 | C05 | C06 | 15.6° | 89.0° |
| C09 | C10 | C05 | C07 | 20.4° | 23.6° |
| C10 | C09 | C08 | C07 | 33.5° | 38.0° |
| C09 | C10 | H102 | H101 | 122.8° | 122.7° |
| C10 | C09 | C08 | H082 | 153.2° | 156.6° |
| C10 | C09 | C08 | H081 | 86.3° | 80.8° |
| C10 | C09 | H091 | H092 | 122.7° | 123.3° |
| C10 | C05 | C03 | O04 | 109.9° | 120.5° |
| C05 | C10 | C09 | C08 | 33.5° | 38.0° |
| C10 | C05 | C03 | N02 | 64.1° | 59.6° |
| C10 | C05 | C03 | C06 | 179.2° | 154.3° |
| C10 | C05 | C03 | C07 | 127.3° | 133.8° |
| C10 | C05 | C06 | C07 | 40.7° | 94.2° |
| C10 | C05 | C07 | C08 | 1.2° | 0.0° |
| C05 | C10 | H102 | H101 | 122.8° | 122.6° |
| C10 | C05 | C06 | H061 | 150.6° | 158.8° |
| C10 | C05 | C06 | H062 | 69.2° | 14.0° |
| C10 | C05 | C07 | H071 | 97.2° | 138.7° |
| C05 | C10 | C09 | H091 | 85.6° | 156.2° |
| C05 | C10 | C09 | H092 | 152.5° | 80.4° |
| C01 | N02 | C03 | O04 | 3.7° | 176.0° |
| C01 | N02 | C03 | C11 | 175.8° | 180.0° |
| C01 | N02 | C03 | C05 | 177.7° | 3.9° |
| C01 | N02 | C11 | C12 | 12.0° | 179.9° |
| C01 | N02 | C11 | C15 | 165.8° | 0.1° |
| N02 | C01 | H012 | H013 | 120.0° | 120.0° |
| N02 | C01 | H012 | H011 | 120.0° | 120.0° |
| N02 | C01 | H013 | H011 | 120.0° | 120.0° |
| O04 | C03 | N02 | C05 | 174.0° | 179.9° |
| O04 | C03 | N02 | C11 | 179.5° | 4.0° |
| O04 | C03 | C05 | C06 | 70.9° | 85.2° |
| O04 | C03 | C05 | C07 | 122.8° | 13.3° |
| C09 | C08 | C07 | C05 | 21.4° | 23.7° |
| C09 | C08 | C07 | H082 | 119.8° | 118.7° |
| C09 | C08 | C07 | H081 | 119.7° | 118.9° |
| C09 | C08 | C07 | C06 | 13.6° | 87.2° |
| C08 | C09 | C10 | H102 | 85.5° | 80.7° |
| C08 | C09 | C10 | H101 | 152.5° | 156.6° |
| C09 | C08 | C07 | H071 | 120.3° | 116.7° |
| C09 | C08 | H082 | H081 | 120.7° | 122.7° |
| C08 | C09 | H091 | H092 | 122.8° | 123.4° |
| C03 | N02 | C11 | C12 | 172.1° | 0.1° |
| C03 | N02 | C11 | C15 | 10.1° | 179.9° |
| N02 | C03 | C05 | C06 | 115.1° | 94.7° |
| N02 | C03 | C05 | C07 | 63.1° | 166.6° |
| C03 | N02 | C01 | H012 | 180.0° | 84.9° |
| C03 | N02 | C01 | H013 | 60.0° | 155.1° |
| C03 | N02 | C01 | H011 | 60.0° | 35.1° |
| C11 | N02 | C03 | C05 | 6.5° | 176.1° |
| N02 | C11 | C12 | C15 | 178.3° | 179.9° |
| N02 | C11 | C12 | N13 | 178.7° | 180.0° |
| N02 | C11 | C15 | N14 | 178.6° | 180.0° |
| N02 | C11 | C15 | H151 | 1.5° | 0.4° |
| C11 | N02 | C01 | H012 | 3.7° | 95.1° |
| C11 | N02 | C01 | H013 | 123.8° | 24.9° |
| C11 | N02 | C01 | H011 | 116.3° | 144.9° |
| N02 | C11 | C12 | H121 | 1.3° | 0.0° |
| C03 | C05 | C06 | C07 | 136.6° | 111.8° |
| C03 | C05 | C07 | C08 | 126.5° | 138.0° |
| C03 | C05 | C10 | H102 | 42.7° | 125.0° |
| C03 | C05 | C10 | H101 | 79.3° | 2.3° |
| C03 | C05 | C06 | H061 | 26.7° | 4.7° |
| C03 | C05 | C06 | H062 | 113.5° | 140.1° |
| C03 | C05 | C07 | H071 | 28.0° | 0.7° |
| C11 | C12 | N13 | H121 | 180.0° | 180.0° |
| C11 | C12 | N13 | N14 | 0.4° | 0.0° |
| C12 | C11 | C15 | N14 | 0.4° | 0.1° |
| C12 | C11 | C15 | H151 | 179.6° | 179.7° |
| N13 | C12 | C11 | C15 | 0.5° | 0.1° |
| C12 | N13 | N14 | C15 | 0.1° | 0.0° |
| C12 | N13 | N14 | H141 | 179.9° | 179.7° |
| C11 | C15 | N14 | N13 | 0.2° | 0.0° |
| C11 | C15 | N14 | H151 | 180.0° | 179.7° |
| C15 | C11 | C12 | H121 | 179.5° | 179.9° |
| C11 | C15 | N14 | H141 | 179.8° | 179.7° |
| C05 | C06 | C07 | C08 | 40.0° | 93.3° |
| C05 | C06 | C07 | H061 | 109.9° | 107.5° |
| C05 | C06 | C07 | H062 | 109.9° | 107.1° |
| C06 | C05 | C10 | H102 | 134.6° | 29.7° |
| C06 | C05 | C10 | H101 | 103.5° | 152.3° |
| C05 | C06 | H061 | H062 | 143.9° | 145.4° |
| C06 | C05 | C07 | H071 | 94.1° | 107.8° |
| C05 | C07 | C08 | H071 | 98.9° | 140.4° |
| C07 | C05 | C10 | H102 | 98.7° | 95.1° |
| C07 | C05 | C10 | H101 | 139.4° | 142.3° |
| C05 | C07 | C08 | H082 | 141.1° | 142.3° |
| C05 | C07 | C08 | H081 | 98.4° | 95.2° |
| N13 | N14 | C15 | H141 | 180.0° | 179.7° |
| N13 | N14 | C15 | H151 | 179.8° | 179.7° |
| N14 | N13 | C12 | H121 | 179.7° | 180.0° |
| C08 | C07 | C06 | H071 | 133.8° | 155.7° |
| C08 | C07 | C06 | H061 | 149.9° | 159.2° |
| C08 | C07 | C06 | H062 | 69.9° | 13.8° |
| C07 | C08 | H082 | H081 | 120.8° | 122.5° |
| C07 | C08 | C09 | H091 | 85.5° | 156.2° |
| C07 | C08 | C09 | H092 | 152.5° | 80.4° |
| C07 | C06 | H061 | H062 | 143.9° | 146.3° |
| C06 | C07 | C08 | H082 | 106.1° | 154.1° |
| C06 | C07 | C08 | H081 | 133.4° | 31.6° |
| H102 | C10 | C09 | H091 | 155.4° | 37.6° |
| H102 | C10 | C09 | H092 | 33.5° | 160.9° |
| H101 | C10 | C09 | H091 | 33.5° | 85.1° |
| H101 | C10 | C09 | H092 | 88.4° | 38.3° |
| H151 | C15 | N14 | H141 | 0.2° | 0.0° |
| H012 | C01 | H013 | H011 | 120.0° | 120.0° |
| H061 | C06 | C07 | H071 | 16.1° | 3.5° |
| H062 | C06 | C07 | H071 | 156.3° | 141.9° |
| H071 | C07 | C08 | H082 | 120.0° | 1.9° |
| H071 | C07 | C08 | H081 | 0.5° | 124.4° |
| H082 | C08 | C09 | H091 | 34.2° | 85.1° |
| H082 | C08 | C09 | H092 | 87.7° | 38.3° |
| H081 | C08 | C09 | H091 | 154.7° | 37.5° |
| H081 | C08 | C09 | H092 | 32.8° | 160.9° |
