NVX
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
CAK | CAV | sing | 1.40Å | 1.42Å | Aromatic |
CAK | CAT | doub | 1.38Å | 1.37Å | Aromatic |
CAV | NAO | sing | 1.36Å | 1.34Å | |
CAV | CAW | doub | 1.41Å | 1.41Å | Aromatic |
NAO | CAI | doub | 1.30Å | 1.42Å | |
CAI | NAP | sing | 1.36Å | 1.35Å | |
NAP | CAU | sing | 1.35Å | 1.39Å | |
CAU | OAB | doub | 1.22Å | 1.26Å | |
CAU | CAW | sing | 1.47Å | 1.41Å | |
CAW | CAH | sing | 1.39Å | 1.41Å | Aromatic |
CAH | CAG | doub | 1.38Å | 1.41Å | Aromatic |
CAG | CAT | sing | 1.39Å | 1.41Å | Aromatic |
CAT | CAY | sing | 1.51Å | 1.46Å | |
CAY | CAM | sing | 1.54Å | 1.63Å | |
CAY | CAX | sing | 1.54Å | 1.52Å | |
CAM | NAN | sing | 1.49Å | 1.49Å | |
NAN | CAL | sing | 1.49Å | 1.50Å | |
CAL | CAX | sing | 1.54Å | 1.60Å | |
CAX | CAQ | sing | 1.51Å | 1.56Å | |
CAQ | OAA | doub | 1.21Å | 1.23Å | |
CAQ | CAS | sing | 1.47Å | 1.42Å | |
CAS | CAJ | sing | 1.40Å | 1.40Å | Aromatic |
CAS | CAF | doub | 1.40Å | 1.40Å | Aromatic |
CAJ | CAR | doub | 1.38Å | 1.41Å | Aromatic |
CAR | CL | sing | 1.74Å | 1.58Å | |
CAR | CAE | sing | 1.38Å | 1.38Å | Aromatic |
CAE | CAD | doub | 1.38Å | 1.39Å | Aromatic |
CAD | CAF | sing | 1.38Å | 1.41Å | Aromatic |
CAK | HAK | sing | 1.08Å | 1.08Å | |
CAI | HAI | sing | 1.08Å | 1.08Å | |
NAP | HAP | sing | 0.97Å | 1.00Å | |
CAH | HAH | sing | 1.08Å | 1.08Å | |
CAG | HAG | sing | 1.08Å | 1.08Å | |
CAY | HAY | sing | 1.09Å | 1.10Å | |
CAM | HAM1 | sing | 1.09Å | 1.10Å | |
CAM | HAM2 | sing | 1.09Å | 1.10Å | |
CAX | HAX | sing | 1.09Å | 1.10Å | |
NAN | HAN | sing | 1.01Å | 1.00Å | |
CAL | HAL1 | sing | 1.09Å | 1.10Å | |
CAL | HAL2 | sing | 1.09Å | 1.10Å | |
CAJ | HAJ | sing | 1.08Å | 1.08Å | |
CAF | HAF | sing | 1.08Å | 1.08Å | |
CAE | HAE | sing | 1.08Å | 1.08Å | |
CAD | HAD | sing | 1.08Å | 1.08Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
CAV | CAK | CAT | 122.8° | 119.7° |
CAK | CAV | NAO | 121.0° | 121.6° |
CAK | CAV | CAW | 120.9° | 119.4° |
CAV | CAK | HAK | 118.6° | 120.1° |
CAK | CAT | CAG | 116.8° | 120.8° |
CAK | CAT | CAY | 123.2° | 119.6° |
CAT | CAK | HAK | 118.6° | 120.2° |
NAO | CAV | CAW | 118.1° | 119.0° |
CAV | NAO | CAI | 118.3° | 121.6° |
CAV | CAW | CAU | 122.8° | 118.0° |
CAV | CAW | CAH | 116.5° | 120.0° |
NAO | CAI | NAP | 124.9° | 123.3° |
NAO | CAI | HAI | 117.5° | 118.3° |
CAI | NAP | CAU | 117.3° | 120.6° |
NAP | CAI | HAI | 117.5° | 118.3° |
CAI | NAP | HAP | 121.3° | 119.7° |
NAP | CAU | OAB | 119.6° | 121.3° |
NAP | CAU | CAW | 118.4° | 117.4° |
CAU | NAP | HAP | 121.4° | 119.7° |
OAB | CAU | CAW | 121.9° | 121.3° |
CAU | CAW | CAH | 120.6° | 121.9° |
CAW | CAH | CAG | 121.6° | 119.5° |
CAW | CAH | HAH | 119.2° | 120.2° |
CAH | CAG | CAT | 121.3° | 120.6° |
CAG | CAH | HAH | 119.2° | 120.3° |
CAH | CAG | HAG | 119.4° | 119.7° |
CAG | CAT | CAY | 119.7° | 119.6° |
CAT | CAG | HAG | 119.3° | 119.7° |
CAT | CAY | CAM | 100.3° | 110.3° |
CAT | CAY | CAX | 124.1° | 110.3° |
CAT | CAY | HAY | 111.1° | 110.3° |
CAM | CAY | CAX | 100.2° | 105.1° |
CAY | CAM | NAN | 106.2° | 104.6° |
CAM | CAY | HAY | 108.9° | 110.3° |
CAY | CAM | HAM1 | 110.3° | 110.4° |
CAY | CAM | HAM2 | 110.3° | 110.4° |
CAY | CAX | CAL | 97.2° | 105.0° |
CAY | CAX | CAQ | 118.5° | 110.3° |
CAX | CAY | HAY | 110.1° | 110.4° |
CAY | CAX | HAX | 111.6° | 110.3° |
CAM | NAN | CAL | 105.1° | 104.3° |
NAN | CAM | HAM1 | 110.3° | 110.4° |
NAN | CAM | HAM2 | 110.3° | 110.4° |
CAM | NAN | HAN | 110.6° | 111.0° |
NAN | CAL | CAX | 107.2° | 104.6° |
CAL | NAN | HAN | 110.6° | 111.0° |
NAN | CAL | HAL1 | 110.0° | 110.4° |
NAN | CAL | HAL2 | 110.0° | 110.4° |
CAL | CAX | CAQ | 106.9° | 110.3° |
CAL | CAX | HAX | 110.4° | 110.3° |
CAX | CAL | HAL1 | 110.0° | 110.4° |
CAX | CAL | HAL2 | 110.0° | 110.4° |
CAX | CAQ | OAA | 118.3° | 120.0° |
CAX | CAQ | CAS | 120.2° | 120.0° |
CAQ | CAX | HAX | 111.0° | 110.4° |
OAA | CAQ | CAS | 121.5° | 120.0° |
CAQ | CAS | CAJ | 122.6° | 120.2° |
CAQ | CAS | CAF | 121.7° | 120.1° |
CAJ | CAS | CAF | 115.7° | 119.7° |
CAS | CAJ | CAR | 119.0° | 119.8° |
CAS | CAJ | HAJ | 120.6° | 120.0° |
CAS | CAF | CAD | 125.1° | 119.8° |
CAS | CAF | HAF | 117.5° | 120.1° |
CAJ | CAR | CL | 121.4° | 119.9° |
CAJ | CAR | CAE | 124.5° | 120.1° |
CAR | CAJ | HAJ | 120.5° | 120.1° |
CL | CAR | CAE | 114.1° | 120.0° |
CAR | CAE | CAD | 117.4° | 120.4° |
CAR | CAE | HAE | 121.3° | 119.8° |
CAE | CAD | CAF | 118.3° | 120.2° |
CAD | CAE | HAE | 121.3° | 119.8° |
CAE | CAD | HAD | 120.9° | 119.9° |
CAD | CAF | HAF | 117.4° | 120.1° |
CAF | CAD | HAD | 120.9° | 119.9° |
HAM1 | CAM | HAM2 | 109.5° | 110.5° |
HAL1 | CAL | HAL2 | 109.5° | 110.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
CAV | CAK | CAT | HAK | 180.0° | 179.7° |
CAK | CAV | NAO | CAW | 179.5° | 179.9° |
CAK | CAV | NAO | CAI | 178.5° | 180.0° |
CAK | CAV | CAW | CAU | 177.6° | 179.9° |
CAK | CAV | CAW | CAH | 1.1° | 0.1° |
CAV | CAK | CAT | CAG | 4.5° | 0.1° |
CAV | CAK | CAT | CAY | 177.9° | 180.0° |
CAT | CAK | CAV | NAO | 177.5° | 180.0° |
CAT | CAK | CAV | CAW | 2.0° | 0.1° |
CAK | CAT | CAG | CAH | 4.1° | 0.0° |
CAK | CAT | CAG | CAY | 173.7° | 180.0° |
CAK | CAT | CAY | CAM | 72.1° | 121.4° |
CAK | CAT | CAY | CAX | 37.8° | 122.9° |
CAK | CAT | CAG | HAG | 175.9° | 179.9° |
CAK | CAT | CAY | HAY | 172.9° | 0.7° |
CAV | NAO | CAI | NAP | 0.4° | 0.1° |
NAO | CAV | CAW | CAU | 3.0° | 0.0° |
NAO | CAV | CAW | CAH | 179.4° | 180.0° |
NAO | CAV | CAK | HAK | 2.5° | 0.3° |
CAV | NAO | CAI | HAI | 179.6° | 179.9° |
CAW | CAV | NAO | CAI | 2.0° | 0.1° |
CAV | CAW | CAU | NAP | 1.4° | 0.0° |
CAV | CAW | CAU | OAB | 175.7° | 180.0° |
CAV | CAW | CAU | CAH | 176.3° | 180.0° |
CAV | CAW | CAH | CAG | 1.5° | 0.0° |
CAW | CAV | CAK | HAK | 178.0° | 179.8° |
CAV | CAW | CAH | HAH | 178.5° | 180.0° |
NAO | CAI | NAP | HAI | 180.0° | 180.0° |
NAO | CAI | NAP | CAU | 1.9° | 0.0° |
NAO | CAI | NAP | HAP | 178.1° | 180.0° |
CAI | NAP | CAU | HAP | 180.0° | 180.0° |
CAI | NAP | CAU | OAB | 178.1° | 180.0° |
CAI | NAP | CAU | CAW | 0.9° | 0.0° |
NAP | CAU | OAB | CAW | 177.1° | 180.0° |
NAP | CAU | CAW | CAH | 177.8° | 180.0° |
CAU | NAP | CAI | HAI | 178.1° | 180.0° |
OAB | CAU | CAW | CAH | 0.6° | 0.0° |
OAB | CAU | NAP | HAP | 1.9° | 0.0° |
CAU | CAW | CAH | CAG | 178.0° | 179.9° |
CAW | CAU | NAP | HAP | 179.1° | 180.0° |
CAU | CAW | CAH | HAH | 2.0° | 0.0° |
CAW | CAH | CAG | HAH | 180.0° | 180.0° |
CAW | CAH | CAG | CAT | 1.1° | 0.0° |
CAW | CAH | CAG | HAG | 178.8° | 179.9° |
CAH | CAG | CAT | HAG | 180.0° | 180.0° |
CAH | CAG | CAT | CAY | 177.7° | 180.0° |
CAG | CAT | CAY | CAM | 101.2° | 58.5° |
CAG | CAT | CAY | CAX | 148.9° | 57.1° |
CAG | CAT | CAK | HAK | 175.5° | 179.7° |
CAT | CAG | CAH | HAH | 178.9° | 180.0° |
CAG | CAT | CAY | HAY | 13.8° | 179.3° |
CAT | CAY | CAM | CAX | 127.8° | 118.9° |
CAT | CAY | CAM | HAY | 116.7° | 122.1° |
CAT | CAY | CAX | HAY | 135.5° | 122.2° |
CAT | CAY | CAM | NAN | 165.5° | 142.7° |
CAT | CAY | CAX | CAL | 156.0° | 118.9° |
CAT | CAY | CAX | CAQ | 90.3° | 122.2° |
CAY | CAT | CAK | HAK | 2.1° | 0.3° |
CAY | CAT | CAG | HAG | 2.2° | 0.0° |
CAT | CAY | CAM | HAM1 | 75.0° | 98.5° |
CAT | CAY | CAM | HAM2 | 46.0° | 24.0° |
CAT | CAY | CAX | HAX | 40.6° | 0.0° |
CAM | CAY | CAX | HAY | 114.5° | 118.9° |
CAY | CAM | NAN | HAM1 | 119.5° | 118.8° |
CAY | CAM | NAN | HAM2 | 119.5° | 118.8° |
CAY | CAM | NAN | CAL | 10.1° | 39.5° |
CAM | CAY | CAX | CAL | 46.0° | 0.0° |
CAM | CAY | CAX | CAQ | 159.7° | 118.9° |
CAY | CAM | HAM1 | HAM2 | 121.5° | 122.4° |
CAM | CAY | CAX | HAX | 69.4° | 118.9° |
CAY | CAM | NAN | HAN | 109.2° | 80.1° |
CAX | CAY | CAM | NAN | 37.8° | 23.8° |
CAY | CAX | CAL | NAN | 43.4° | 23.9° |
CAY | CAX | CAL | CAQ | 122.8° | 118.9° |
CAY | CAX | CAL | HAX | 116.3° | 118.9° |
CAY | CAX | CAQ | HAX | 131.1° | 122.2° |
CAY | CAX | CAQ | OAA | 14.0° | 30.0° |
CAY | CAX | CAQ | CAS | 168.3° | 150.0° |
CAX | CAY | CAM | HAM1 | 157.2° | 142.6° |
CAX | CAY | CAM | HAM2 | 81.8° | 94.9° |
CAY | CAX | CAL | HAL1 | 76.3° | 142.7° |
CAY | CAX | CAL | HAL2 | 163.0° | 94.9° |
CAM | NAN | CAL | HAN | 119.3° | 119.6° |
CAM | NAN | CAL | CAX | 20.0° | 39.5° |
NAN | CAM | CAY | HAY | 77.8° | 95.2° |
NAN | CAM | HAM1 | HAM2 | 121.5° | 122.4° |
CAM | NAN | CAL | HAL1 | 99.6° | 158.3° |
CAM | NAN | CAL | HAL2 | 139.7° | 79.3° |
NAN | CAL | CAX | HAL1 | 119.7° | 118.8° |
NAN | CAL | CAX | HAL2 | 119.6° | 118.8° |
NAN | CAL | CAX | CAQ | 166.1° | 95.0° |
CAL | NAN | CAM | HAM1 | 129.6° | 158.3° |
CAL | NAN | CAM | HAM2 | 109.4° | 79.3° |
NAN | CAL | CAX | HAX | 72.9° | 142.7° |
NAN | CAL | HAL1 | HAL2 | 121.0° | 122.4° |
CAL | CAX | CAQ | HAX | 120.5° | 122.2° |
CAL | CAX | CAQ | OAA | 94.4° | 85.6° |
CAL | CAX | CAQ | CAS | 83.4° | 94.4° |
CAL | CAX | CAY | HAY | 68.6° | 118.9° |
CAX | CAL | NAN | HAN | 139.3° | 80.1° |
CAX | CAL | HAL1 | HAL2 | 121.0° | 122.4° |
CAX | CAQ | OAA | CAS | 177.7° | 180.0° |
CAX | CAQ | CAS | CAJ | 169.3° | 180.0° |
CAX | CAQ | CAS | CAF | 13.6° | 0.3° |
CAQ | CAX | CAY | HAY | 45.2° | 0.1° |
CAQ | CAX | CAL | HAL1 | 46.5° | 23.8° |
CAQ | CAX | CAL | HAL2 | 74.2° | 146.2° |
OAA | CAQ | CAS | CAJ | 13.0° | 0.0° |
OAA | CAQ | CAS | CAF | 164.1° | 179.8° |
OAA | CAQ | CAX | HAX | 145.1° | 152.1° |
CAQ | CAS | CAJ | CAF | 177.3° | 179.8° |
CAQ | CAS | CAJ | CAR | 180.0° | 180.0° |
CAQ | CAS | CAF | CAD | 179.7° | 179.7° |
CAS | CAQ | CAX | HAX | 37.2° | 27.8° |
CAQ | CAS | CAJ | HAJ | 0.1° | 0.0° |
CAQ | CAS | CAF | HAF | 0.3° | 0.0° |
CAS | CAJ | CAR | HAJ | 180.0° | 180.0° |
CAS | CAJ | CAR | CL | 177.6° | 180.0° |
CAS | CAJ | CAR | CAE | 2.0° | 0.0° |
CAJ | CAS | CAF | CAD | 3.0° | 0.5° |
CAJ | CAS | CAF | HAF | 177.0° | 179.7° |
CAF | CAS | CAJ | CAR | 2.7° | 0.3° |
CAS | CAF | CAD | CAE | 2.4° | 0.6° |
CAS | CAF | CAD | HAF | 180.0° | 179.7° |
CAF | CAS | CAJ | HAJ | 177.3° | 179.7° |
CAS | CAF | CAD | HAD | 177.7° | 179.7° |
CAJ | CAR | CL | CAE | 179.6° | 180.0° |
CAJ | CAR | CAE | CAD | 1.2° | 0.0° |
CAJ | CAR | CAE | HAE | 178.8° | 180.0° |
CL | CAR | CAE | CAD | 178.4° | 180.0° |
CL | CAR | CAJ | HAJ | 2.4° | 0.0° |
CL | CAR | CAE | HAE | 1.6° | 0.0° |
CAR | CAE | CAD | HAE | 180.0° | 180.0° |
CAR | CAE | CAD | CAF | 1.3° | 0.3° |
CAE | CAR | CAJ | HAJ | 178.0° | 180.0° |
CAR | CAE | CAD | HAD | 178.7° | 180.0° |
CAE | CAD | CAF | HAD | 180.0° | 179.7° |
CAE | CAD | CAF | HAF | 177.6° | 179.7° |
CAF | CAD | CAE | HAE | 178.7° | 179.7° |
HAI | CAI | NAP | HAP | 1.9° | 0.0° |
HAH | CAH | CAG | HAG | 1.2° | 0.0° |
HAY | CAY | CAM | HAM1 | 41.7° | 23.6° |
HAY | CAY | CAM | HAM2 | 162.7° | 146.1° |
HAY | CAY | CAX | HAX | 176.1° | 122.2° |
HAM1 | CAM | NAN | HAN | 10.3° | 38.7° |
HAM2 | CAM | NAN | HAN | 131.3° | 161.1° |
HAX | CAX | CAL | HAL1 | 167.4° | 98.5° |
HAX | CAX | CAL | HAL2 | 46.7° | 23.9° |
HAN | NAN | CAL | HAL1 | 19.7° | 38.7° |
HAN | NAN | CAL | HAL2 | 101.0° | 161.2° |
HAF | CAF | CAD | HAD | 2.4° | 0.0° |
HAE | CAE | CAD | HAD | 1.3° | 0.0° |