KN0
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
CAB | CAA | doub | 1.39Å | 1.39Å | Aromatic |
CAA | CAF | sing | 1.38Å | 1.39Å | Aromatic |
CAA | HAA | sing | 1.08Å | 1.08Å | |
CAB | CAC | sing | 1.37Å | 1.39Å | Aromatic |
CAB | HAB | sing | 1.08Å | 1.08Å | |
CAC | CAD | doub | 1.40Å | 1.39Å | Aromatic |
CAC | HAC | sing | 1.08Å | 1.08Å | |
CAD | CAE | sing | 1.41Å | 1.39Å | Aromatic |
CAD | CAG | sing | 1.47Å | 1.39Å | Aromatic |
CAF | CAE | doub | 1.39Å | 1.40Å | Aromatic |
CAE | NAI | sing | 1.37Å | 1.34Å | Aromatic |
CAY | CAF | sing | 1.51Å | 1.54Å | |
CAG | CAJ | sing | 1.48Å | 1.40Å | Aromatic |
CAG | NAH | doub | 1.31Å | 1.33Å | Aromatic |
NAI | NAH | sing | 1.40Å | 1.24Å | Aromatic |
NAI | CAK | sing | 1.47Å | 1.47Å | |
CAL | CAJ | doub | 1.39Å | 1.39Å | Aromatic |
CAJ | CAP | sing | 1.40Å | 1.40Å | Aromatic |
CAK | CAS | sing | 1.51Å | 1.54Å | |
CAK | HAK | sing | 1.09Å | 1.10Å | |
CAK | HAKA | sing | 1.09Å | 1.10Å | |
CAL | CAM | sing | 1.38Å | 1.40Å | Aromatic |
CAL | HAL | sing | 1.08Å | 1.08Å | |
CAM | CAN | doub | 1.39Å | 1.39Å | Aromatic |
CAM | HAM | sing | 1.08Å | 1.08Å | |
CAN | OAR | sing | 1.36Å | 1.36Å | |
CAN | CAO | sing | 1.39Å | 1.39Å | Aromatic |
CAP | CAO | doub | 1.38Å | 1.39Å | Aromatic |
CAO | HAO | sing | 1.08Å | 1.08Å | |
CAP | OAQ | sing | 1.36Å | 1.35Å | |
OAQ | HOAQ | sing | 0.97Å | 0.95Å | |
OAR | HOAR | sing | 0.97Å | 0.95Å | |
CAS | CAX | doub | 1.38Å | 1.39Å | Aromatic |
CAS | CAT | sing | 1.38Å | 1.39Å | Aromatic |
CAT | CAU | doub | 1.38Å | 1.39Å | Aromatic |
CAT | HAT | sing | 1.08Å | 1.08Å | |
CAU | CAV | sing | 1.38Å | 1.39Å | Aromatic |
CAU | HAU | sing | 1.08Å | 1.08Å | |
CAW | CAV | doub | 1.38Å | 1.39Å | Aromatic |
CAV | HAV | sing | 1.08Å | 1.08Å | |
CAX | CAW | sing | 1.38Å | 1.39Å | Aromatic |
CAW | HAW | sing | 1.08Å | 1.08Å | |
CAX | HAX | sing | 1.08Å | 1.08Å | |
FAZ | CAY | sing | 1.40Å | 1.33Å | |
FBB | CAY | sing | 1.40Å | 1.32Å | |
CAY | FBA | sing | 1.40Å | 1.33Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
CAB | CAA | CAF | 120.6° | 120.7° |
CAB | CAA | HAA | 119.7° | 119.7° |
CAA | CAB | CAC | 119.9° | 120.6° |
CAA | CAB | HAB | 120.1° | 119.8° |
CAF | CAA | HAA | 119.7° | 119.7° |
CAA | CAF | CAE | 119.3° | 119.7° |
CAA | CAF | CAY | 118.0° | 120.1° |
CAC | CAB | HAB | 120.1° | 119.7° |
CAB | CAC | CAD | 120.0° | 119.8° |
CAB | CAC | HAC | 120.0° | 120.1° |
CAD | CAC | HAC | 120.0° | 120.1° |
CAC | CAD | CAE | 120.3° | 119.8° |
CAC | CAD | CAG | 134.4° | 133.9° |
CAE | CAD | CAG | 105.2° | 106.3° |
CAD | CAE | CAF | 119.9° | 119.4° |
CAD | CAE | NAI | 105.0° | 106.9° |
CAD | CAG | CAJ | 125.2° | 126.2° |
CAD | CAG | NAH | 106.8° | 107.5° |
CAF | CAE | NAI | 135.1° | 133.7° |
CAE | CAF | CAY | 122.7° | 120.1° |
CAE | NAI | NAH | 112.7° | 109.3° |
CAE | NAI | CAK | 125.5° | 125.3° |
CAF | CAY | FAZ | 110.2° | 109.5° |
CAF | CAY | FBB | 107.2° | 109.5° |
CAF | CAY | FBA | 113.1° | 109.5° |
CAJ | CAG | NAH | 127.4° | 126.3° |
CAG | CAJ | CAL | 121.7° | 120.1° |
CAG | CAJ | CAP | 119.2° | 120.1° |
CAG | NAH | NAI | 110.1° | 110.0° |
NAH | NAI | CAK | 121.9° | 125.4° |
NAI | CAK | CAS | 106.4° | 109.5° |
NAI | CAK | HAK | 110.5° | 109.5° |
NAI | CAK | HAKA | 110.5° | 109.5° |
CAL | CAJ | CAP | 119.0° | 119.8° |
CAJ | CAL | CAM | 120.0° | 119.9° |
CAJ | CAL | HAL | 120.0° | 120.0° |
CAJ | CAP | CAO | 120.8° | 119.8° |
CAJ | CAP | OAQ | 121.5° | 120.1° |
CAS | CAK | HAK | 110.5° | 109.4° |
CAS | CAK | HAKA | 110.5° | 109.5° |
CAK | CAS | CAX | 119.4° | 120.0° |
CAK | CAS | CAT | 121.2° | 120.0° |
HAK | CAK | HAKA | 108.4° | 109.5° |
CAM | CAL | HAL | 120.0° | 120.0° |
CAL | CAM | CAN | 120.4° | 120.2° |
CAL | CAM | HAM | 119.8° | 119.9° |
CAN | CAM | HAM | 119.8° | 119.9° |
CAM | CAN | OAR | 121.9° | 119.9° |
CAM | CAN | CAO | 119.5° | 120.2° |
OAR | CAN | CAO | 118.6° | 119.9° |
CAN | OAR | HOAR | 109.5° | 114.0° |
CAN | CAO | CAP | 120.1° | 120.0° |
CAN | CAO | HAO | 119.9° | 120.0° |
CAP | CAO | HAO | 119.9° | 119.9° |
CAO | CAP | OAQ | 117.6° | 120.1° |
CAP | OAQ | HOAQ | 109.5° | 114.0° |
CAX | CAS | CAT | 119.4° | 120.0° |
CAS | CAX | CAW | 120.3° | 120.0° |
CAS | CAX | HAX | 119.9° | 120.0° |
CAS | CAT | CAU | 120.4° | 120.0° |
CAS | CAT | HAT | 119.8° | 120.0° |
CAU | CAT | HAT | 119.8° | 120.0° |
CAT | CAU | CAV | 120.0° | 120.0° |
CAT | CAU | HAU | 120.0° | 120.0° |
CAV | CAU | HAU | 120.0° | 120.0° |
CAU | CAV | CAW | 119.8° | 120.0° |
CAU | CAV | HAV | 120.1° | 120.0° |
CAW | CAV | HAV | 120.2° | 120.1° |
CAV | CAW | CAX | 120.1° | 120.0° |
CAV | CAW | HAW | 119.9° | 120.0° |
CAX | CAW | HAW | 119.9° | 120.0° |
CAW | CAX | HAX | 119.9° | 120.0° |
FAZ | CAY | FBB | 107.9° | 109.5° |
FAZ | CAY | FBA | 109.5° | 109.5° |
FBB | CAY | FBA | 108.8° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
CAB | CAA | CAF | HAA | 180.0° | 179.7° |
CAA | CAB | CAC | HAB | 180.0° | 179.9° |
CAA | CAB | CAC | CAD | 0.0° | 0.1° |
CAA | CAB | CAC | HAC | 180.0° | 180.0° |
CAB | CAA | CAF | CAE | 0.7° | 0.0° |
CAB | CAA | CAF | CAY | 179.1° | 179.7° |
CAF | CAA | CAB | CAC | 0.3° | 0.0° |
CAF | CAA | CAB | HAB | 179.7° | 179.9° |
CAA | CAF | CAE | CAD | 0.7° | 0.0° |
CAA | CAF | CAE | CAY | 178.3° | 179.7° |
CAA | CAF | CAE | NAI | 179.7° | 180.0° |
CAA | CAF | CAY | FAZ | 3.2° | 120.0° |
CAA | CAF | CAY | FBB | 114.0° | 120.1° |
CAA | CAF | CAY | FBA | 126.1° | 0.1° |
HAA | CAA | CAB | CAC | 179.7° | 179.7° |
HAA | CAA | CAB | HAB | 0.3° | 0.3° |
HAA | CAA | CAF | CAE | 179.3° | 179.7° |
HAA | CAA | CAF | CAY | 0.9° | 0.0° |
CAB | CAC | CAD | HAC | 180.0° | 180.0° |
CAB | CAC | CAD | CAE | 0.0° | 0.0° |
CAB | CAC | CAD | CAG | 177.4° | 179.9° |
HAB | CAB | CAC | CAD | 179.9° | 180.0° |
HAB | CAB | CAC | HAC | 0.0° | 0.1° |
CAC | CAD | CAE | CAG | 178.1° | 180.0° |
CAC | CAD | CAE | CAF | 0.4° | 0.0° |
CAC | CAD | CAE | NAI | 179.9° | 180.0° |
CAC | CAD | CAG | CAJ | 6.6° | 0.1° |
CAC | CAD | CAG | NAH | 178.2° | 180.0° |
HAC | CAC | CAD | CAE | 180.0° | 180.0° |
HAC | CAC | CAD | CAG | 2.6° | 0.0° |
CAD | CAE | CAF | NAI | 179.5° | 180.0° |
CAD | CAE | CAF | CAY | 179.1° | 179.7° |
CAE | CAD | CAG | CAJ | 175.8° | 180.0° |
CAE | CAD | CAG | NAH | 4.1° | 0.0° |
CAD | CAE | NAI | NAH | 1.0° | 0.0° |
CAD | CAE | NAI | CAK | 179.1° | 180.0° |
CAG | CAD | CAE | CAF | 177.7° | 180.0° |
CAG | CAD | CAE | NAI | 2.0° | 0.0° |
CAD | CAG | CAJ | NAH | 169.9° | 179.9° |
CAD | CAG | NAH | NAI | 4.9° | 0.0° |
CAD | CAG | CAJ | CAL | 19.0° | 46.5° |
CAD | CAG | CAJ | CAP | 164.4° | 133.7° |
CAF | CAE | NAI | NAH | 179.4° | 180.0° |
CAF | CAE | NAI | CAK | 0.5° | 0.0° |
CAE | CAF | CAY | FAZ | 178.5° | 59.7° |
CAE | CAF | CAY | FBB | 64.4° | 60.2° |
CAE | CAF | CAY | FBA | 55.6° | 179.7° |
NAI | CAE | CAF | CAY | 1.4° | 0.3° |
CAE | NAI | NAH | CAG | 3.7° | 0.0° |
CAE | NAI | NAH | CAK | 179.9° | 180.0° |
CAE | NAI | CAK | CAS | 89.1° | 119.7° |
CAE | NAI | CAK | HAK | 30.9° | 120.3° |
CAE | NAI | CAK | HAKA | 150.9° | 0.3° |
CAF | CAY | FAZ | FBB | 116.7° | 120.0° |
CAF | CAY | FAZ | FBA | 125.0° | 120.0° |
CAF | CAY | FBB | FBA | 122.6° | 120.0° |
CAJ | CAG | NAH | NAI | 176.3° | 179.9° |
CAG | CAJ | CAL | CAP | 176.6° | 179.7° |
CAG | CAJ | CAL | CAM | 179.1° | 180.0° |
CAG | CAJ | CAL | HAL | 0.9° | 0.0° |
CAG | CAJ | CAP | CAO | 179.7° | 179.7° |
CAG | CAJ | CAP | OAQ | 3.6° | 0.1° |
CAG | NAH | NAI | CAK | 176.3° | 180.0° |
NAH | CAG | CAJ | CAL | 171.0° | 133.6° |
NAH | CAG | CAJ | CAP | 5.5° | 46.1° |
NAH | NAI | CAK | CAS | 91.0° | 60.3° |
NAH | NAI | CAK | HAK | 149.1° | 59.7° |
NAH | NAI | CAK | HAKA | 29.0° | 179.7° |
NAI | CAK | CAS | HAK | 120.0° | 120.0° |
NAI | CAK | CAS | HAKA | 120.0° | 120.0° |
NAI | CAK | HAK | HAKA | 121.3° | 120.1° |
NAI | CAK | CAS | CAX | 10.4° | 85.3° |
NAI | CAK | CAS | CAT | 168.8° | 94.4° |
CAJ | CAL | CAM | HAL | 180.0° | 180.0° |
CAJ | CAL | CAM | CAN | 0.6° | 0.1° |
CAJ | CAL | CAM | HAM | 179.4° | 180.0° |
CAL | CAJ | CAP | CAO | 3.6° | 0.5° |
CAL | CAJ | CAP | OAQ | 179.7° | 179.7° |
CAP | CAJ | CAL | CAM | 2.5° | 0.2° |
CAP | CAJ | CAL | HAL | 177.5° | 179.7° |
CAJ | CAP | CAO | CAN | 2.8° | 0.6° |
CAJ | CAP | CAO | OAQ | 176.3° | 179.8° |
CAJ | CAP | CAO | HAO | 177.2° | 179.7° |
CAJ | CAP | OAQ | HOAQ | 180.0° | 90.0° |
CAS | CAK | HAK | HAKA | 121.3° | 120.0° |
CAK | CAS | CAX | CAT | 179.2° | 179.7° |
CAK | CAS | CAT | CAU | 179.8° | 180.0° |
CAK | CAS | CAT | HAT | 0.2° | 0.0° |
CAK | CAS | CAX | CAW | 179.9° | 179.8° |
CAK | CAS | CAX | HAX | 0.1° | 0.0° |
HAK | CAK | CAS | CAX | 130.4° | 34.7° |
HAK | CAK | CAS | CAT | 48.8° | 145.6° |
HAKA | CAK | CAS | CAX | 109.6° | 154.7° |
HAKA | CAK | CAS | CAT | 71.2° | 25.6° |
CAL | CAM | CAN | HAM | 180.0° | 179.9° |
CAL | CAM | CAN | OAR | 179.9° | 179.9° |
CAL | CAM | CAN | CAO | 0.3° | 0.0° |
HAL | CAL | CAM | CAN | 179.4° | 180.0° |
HAL | CAL | CAM | HAM | 0.6° | 0.0° |
CAM | CAN | OAR | CAO | 179.6° | 180.0° |
CAM | CAN | CAO | CAP | 0.8° | 0.3° |
CAM | CAN | CAO | HAO | 179.2° | 180.0° |
CAM | CAN | OAR | HOAR | 180.0° | 90.0° |
HAM | CAM | CAN | OAR | 0.1° | 0.0° |
HAM | CAM | CAN | CAO | 179.7° | 180.0° |
OAR | CAN | CAO | CAP | 178.8° | 179.7° |
OAR | CAN | CAO | HAO | 1.1° | 0.0° |
CAN | CAO | CAP | HAO | 180.0° | 179.7° |
CAN | CAO | CAP | OAQ | 179.1° | 179.6° |
CAO | CAN | OAR | HOAR | 0.4° | 90.0° |
CAO | CAP | OAQ | HOAQ | 3.7° | 89.8° |
HAO | CAO | CAP | OAQ | 1.0° | 0.1° |
CAX | CAS | CAT | CAU | 0.6° | 0.3° |
CAX | CAS | CAT | HAT | 179.4° | 179.7° |
CAS | CAX | CAW | CAV | 0.5° | 0.5° |
CAS | CAX | CAW | HAX | 180.0° | 179.7° |
CAS | CAX | CAW | HAW | 179.5° | 179.7° |
CAS | CAT | CAU | HAT | 180.0° | 180.0° |
CAS | CAT | CAU | CAV | 0.4° | 0.0° |
CAS | CAT | CAU | HAU | 179.6° | 180.0° |
CAT | CAS | CAX | CAW | 0.7° | 0.5° |
CAT | CAS | CAX | HAX | 179.3° | 179.7° |
CAT | CAU | CAV | HAU | 180.0° | 180.0° |
CAT | CAU | CAV | CAW | 0.2° | 0.0° |
CAT | CAU | CAV | HAV | 179.8° | 180.0° |
HAT | CAT | CAU | CAV | 179.6° | 180.0° |
HAT | CAT | CAU | HAU | 0.4° | 0.0° |
CAU | CAV | CAW | HAV | 180.0° | 180.0° |
CAU | CAV | CAW | CAX | 0.3° | 0.3° |
CAU | CAV | CAW | HAW | 179.7° | 180.0° |
HAU | CAU | CAV | CAW | 179.8° | 180.0° |
HAU | CAU | CAV | HAV | 0.2° | 0.0° |
CAV | CAW | CAX | HAW | 180.0° | 179.7° |
CAV | CAW | CAX | HAX | 179.5° | 179.8° |
HAV | CAV | CAW | CAX | 179.7° | 179.8° |
HAV | CAV | CAW | HAW | 0.3° | 0.0° |
HAW | CAW | CAX | HAX | 0.5° | 0.0° |
FAZ | CAY | FBB | FBA | 118.8° | 120.0° |