VN0
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
OAI | CAF | sing | 1.43Å | 1.44Å | |
CAF | CAA | sing | 1.53Å | 1.52Å | |
CAA | CAB | sing | 1.55Å | 1.50Å | |
CAA | NAE | sing | 1.48Å | 1.46Å | |
CAB | CAC | sing | 1.55Å | 1.50Å | |
CAB | OAG | sing | 1.43Å | 1.44Å | |
NAE | CAD | sing | 1.47Å | 1.47Å | |
CAC | CAD | sing | 1.54Å | 1.51Å | |
CAC | OAH | sing | 1.43Å | 1.42Å | |
CAJ | CAD | sing | 1.53Å | 1.52Å | |
CAJ | NAK | sing | 1.47Å | 1.47Å | |
NAK | CAL | sing | 1.47Å | 1.47Å | |
CAA | H1 | sing | 1.09Å | 1.10Å | |
CAB | H2 | sing | 1.09Å | 1.10Å | |
CAC | H3 | sing | 1.09Å | 1.10Å | |
CAD | H4 | sing | 1.09Å | 1.10Å | |
CAF | H5 | sing | 1.09Å | 1.10Å | |
CAF | H6 | sing | 1.09Å | 1.10Å | |
CAJ | H7 | sing | 1.09Å | 1.10Å | |
CAJ | H8 | sing | 1.09Å | 1.10Å | |
CAL | H9 | sing | 1.09Å | 1.10Å | |
CAL | H10 | sing | 1.09Å | 1.10Å | |
CAL | H11 | sing | 1.09Å | 1.10Å | |
NAE | H12 | sing | 1.01Å | 1.00Å | |
NAK | H14 | sing | 1.01Å | 1.00Å | |
OAG | H16 | sing | 0.97Å | 0.95Å | |
OAH | H17 | sing | 0.97Å | 0.95Å | |
OAI | H18 | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
OAI | CAF | CAA | 109.5° | 109.5° |
OAI | CAF | H5 | 109.5° | 109.5° |
OAI | CAF | H6 | 109.4° | 109.5° |
CAF | OAI | H18 | 109.5° | 114.0° |
CAF | CAA | CAB | 110.9° | 110.4° |
CAF | CAA | NAE | 108.9° | 110.4° |
CAF | CAA | H1 | 110.2° | 110.4° |
CAA | CAF | H5 | 109.5° | 109.5° |
CAA | CAF | H6 | 109.5° | 109.4° |
CAB | CAA | NAE | 105.3° | 104.8° |
CAA | CAB | CAC | 101.2° | 101.7° |
CAA | CAB | OAG | 109.4° | 111.0° |
CAB | CAA | H1 | 110.4° | 110.4° |
CAA | CAB | H2 | 111.6° | 111.0° |
CAA | NAE | CAD | 107.4° | 108.6° |
NAE | CAA | H1 | 111.0° | 110.4° |
CAA | NAE | H12 | 110.0° | 111.0° |
CAC | CAB | OAG | 109.7° | 111.0° |
CAB | CAC | CAD | 102.7° | 103.0° |
CAB | CAC | OAH | 110.8° | 110.7° |
CAC | CAB | H2 | 111.7° | 111.0° |
CAB | CAC | H3 | 110.6° | 110.7° |
OAG | CAB | H2 | 112.7° | 110.9° |
CAB | OAG | H16 | 109.5° | 114.0° |
NAE | CAD | CAC | 105.6° | 107.2° |
NAE | CAD | CAJ | 107.9° | 110.0° |
NAE | CAD | H4 | 111.2° | 109.8° |
CAD | NAE | H12 | 110.0° | 111.0° |
CAD | CAC | OAH | 110.2° | 110.7° |
CAC | CAD | CAJ | 111.0° | 109.9° |
CAD | CAC | H3 | 110.4° | 110.7° |
CAC | CAD | H4 | 110.6° | 109.9° |
OAH | CAC | H3 | 111.7° | 110.7° |
CAC | OAH | H17 | 109.5° | 114.0° |
CAD | CAJ | NAK | 111.8° | 109.5° |
CAJ | CAD | H4 | 110.4° | 109.9° |
CAD | CAJ | H7 | 108.9° | 109.5° |
CAD | CAJ | H8 | 108.9° | 109.5° |
CAJ | NAK | CAL | 105.1° | 111.0° |
NAK | CAJ | H7 | 108.9° | 109.5° |
NAK | CAJ | H8 | 108.9° | 109.4° |
CAJ | NAK | H14 | 110.6° | 111.0° |
NAK | CAL | H9 | 109.5° | 109.5° |
NAK | CAL | H10 | 109.5° | 109.4° |
NAK | CAL | H11 | 109.5° | 109.5° |
CAL | NAK | H14 | 110.6° | 111.0° |
H5 | CAF | H6 | 109.5° | 109.5° |
H7 | CAJ | H8 | 109.5° | 109.4° |
H9 | CAL | H10 | 109.5° | 109.5° |
H9 | CAL | H11 | 109.5° | 109.5° |
H10 | CAL | H11 | 109.5° | 109.4° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
OAI | CAF | CAA | H5 | 120.0° | 120.1° |
OAI | CAF | CAA | H6 | 120.0° | 120.0° |
OAI | CAF | CAA | CAB | 162.4° | 175.0° |
OAI | CAF | CAA | NAE | 82.2° | 69.6° |
OAI | CAF | CAA | H1 | 39.8° | 52.7° |
OAI | CAF | H5 | H6 | 120.0° | 120.0° |
CAF | CAA | CAB | NAE | 117.7° | 118.9° |
CAF | CAA | CAB | H1 | 122.5° | 122.3° |
CAF | CAA | NAE | H1 | 121.5° | 122.3° |
CAF | CAA | CAB | CAC | 155.8° | 155.9° |
CAF | CAA | CAB | OAG | 40.1° | 37.9° |
CAF | CAA | NAE | CAD | 138.8° | 142.9° |
CAF | CAA | CAB | H2 | 85.3° | 86.0° |
CAA | CAF | H5 | H6 | 120.0° | 120.0° |
CAF | CAA | NAE | H12 | 101.5° | 94.8° |
CAA | CAF | OAI | H18 | 180.0° | 180.0° |
CAB | CAA | NAE | H1 | 119.5° | 118.8° |
CAA | CAB | CAC | OAG | 115.5° | 118.1° |
CAA | CAB | CAC | H2 | 118.9° | 118.1° |
CAA | CAB | OAG | H2 | 124.8° | 123.9° |
CAB | CAA | NAE | CAD | 19.8° | 24.1° |
CAA | CAB | CAC | CAD | 41.3° | 35.6° |
CAA | CAB | CAC | OAH | 159.0° | 154.0° |
CAA | CAB | CAC | H3 | 76.5° | 82.7° |
CAB | CAA | CAF | H5 | 77.6° | 54.9° |
CAB | CAA | CAF | H6 | 42.4° | 65.0° |
CAB | CAA | NAE | H12 | 139.4° | 146.3° |
CAA | CAB | OAG | H16 | 180.0° | 180.0° |
NAE | CAA | CAB | CAC | 38.1° | 37.0° |
NAE | CAA | CAB | OAG | 77.6° | 81.0° |
CAA | NAE | CAD | H12 | 119.7° | 122.3° |
CAA | NAE | CAD | CAC | 6.5° | 1.0° |
CAA | NAE | CAD | CAJ | 125.2° | 118.5° |
NAE | CAA | CAB | H2 | 157.0° | 155.1° |
CAA | NAE | CAD | H4 | 113.5° | 120.4° |
NAE | CAA | CAF | H5 | 37.8° | 170.3° |
NAE | CAA | CAF | H6 | 157.8° | 50.4° |
CAC | CAB | OAG | H2 | 125.0° | 123.8° |
CAB | CAC | CAD | NAE | 30.1° | 22.2° |
CAB | CAC | CAD | OAH | 118.1° | 118.4° |
CAB | CAC | CAD | H3 | 118.0° | 118.4° |
CAB | CAC | OAH | H3 | 123.9° | 123.2° |
CAB | CAC | CAD | CAJ | 146.8° | 141.8° |
CAC | CAB | CAA | H1 | 81.8° | 81.8° |
CAB | CAC | CAD | H4 | 90.3° | 97.1° |
CAC | CAB | OAG | H16 | 69.8° | 67.7° |
CAB | CAC | OAH | H17 | 180.0° | 61.4° |
OAG | CAB | CAC | CAD | 74.2° | 82.4° |
OAG | CAB | CAC | OAH | 43.5° | 36.0° |
OAG | CAB | CAA | H1 | 162.6° | 160.2° |
OAG | CAB | CAC | H3 | 168.0° | 159.2° |
NAE | CAD | CAC | CAJ | 116.7° | 119.6° |
NAE | CAD | CAC | H4 | 120.4° | 119.4° |
NAE | CAD | CAC | OAH | 148.2° | 140.7° |
NAE | CAD | CAJ | H4 | 121.7° | 121.0° |
NAE | CAD | CAJ | NAK | 157.5° | 57.1° |
CAD | NAE | CAA | H1 | 99.7° | 94.7° |
NAE | CAD | CAC | H3 | 87.8° | 96.1° |
NAE | CAD | CAJ | H7 | 82.2° | 177.1° |
NAE | CAD | CAJ | H8 | 37.1° | 62.9° |
CAD | CAC | OAH | H3 | 123.2° | 123.2° |
CAC | CAD | CAJ | H4 | 123.0° | 121.1° |
CAC | CAD | CAJ | NAK | 87.3° | 175.0° |
CAD | CAC | CAB | H2 | 160.2° | 153.8° |
CAC | CAD | CAJ | H7 | 33.1° | 65.0° |
CAC | CAD | CAJ | H8 | 152.3° | 55.0° |
CAC | CAD | NAE | H12 | 113.2° | 123.3° |
CAD | CAC | OAH | H17 | 67.0° | 175.1° |
OAH | CAC | CAD | CAJ | 95.1° | 99.7° |
OAH | CAC | CAB | H2 | 82.1° | 87.8° |
OAH | CAC | CAD | H4 | 27.8° | 21.3° |
CAD | CAJ | NAK | H7 | 120.3° | 120.1° |
CAD | CAJ | NAK | H8 | 120.3° | 120.0° |
CAD | CAJ | NAK | CAL | 165.2° | 180.0° |
CAJ | CAD | CAC | H3 | 28.8° | 23.4° |
CAD | CAJ | H7 | H8 | 118.9° | 120.0° |
CAJ | CAD | NAE | H12 | 5.5° | 3.7° |
CAD | CAJ | NAK | H14 | 45.8° | 56.0° |
CAJ | NAK | CAL | H14 | 119.3° | 124.0° |
NAK | CAJ | CAD | H4 | 35.8° | 63.9° |
NAK | CAJ | H7 | H8 | 119.0° | 119.9° |
CAJ | NAK | CAL | H9 | 180.0° | 180.0° |
CAJ | NAK | CAL | H10 | 60.0° | 60.0° |
CAJ | NAK | CAL | H11 | 60.0° | 60.0° |
CAL | NAK | CAJ | H7 | 74.5° | 60.0° |
CAL | NAK | CAJ | H8 | 44.8° | 60.0° |
NAK | CAL | H9 | H10 | 120.0° | 120.0° |
NAK | CAL | H9 | H11 | 120.0° | 120.0° |
NAK | CAL | H10 | H11 | 120.0° | 120.0° |
H1 | CAA | CAB | H2 | 37.2° | 36.3° |
H1 | CAA | CAF | H5 | 159.8° | 67.4° |
H1 | CAA | CAF | H6 | 80.2° | 172.7° |
H1 | CAA | NAE | H12 | 20.0° | 27.5° |
H2 | CAB | CAC | H3 | 42.4° | 35.4° |
H2 | CAB | OAG | H16 | 55.2° | 56.1° |
H3 | CAC | CAD | H4 | 151.8° | 144.5° |
H3 | CAC | OAH | H17 | 56.1° | 61.8° |
H4 | CAD | CAJ | H7 | 156.1° | 56.1° |
H4 | CAD | CAJ | H8 | 84.6° | 176.1° |
H4 | CAD | NAE | H12 | 126.8° | 117.3° |
H5 | CAF | OAI | H18 | 60.0° | 60.0° |
H6 | CAF | OAI | H18 | 60.0° | 60.0° |
H7 | CAJ | NAK | H14 | 166.2° | 176.1° |
H8 | CAJ | NAK | H14 | 74.5° | 64.0° |
H9 | CAL | H10 | H11 | 120.0° | 120.1° |
H9 | CAL | NAK | H14 | 60.7° | 56.0° |
H10 | CAL | NAK | H14 | 179.3° | 176.0° |
H11 | CAL | NAK | H14 | 59.3° | 64.0° |