RTZ
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
CAA | NAV | sing | 1.47Å | 1.47Å | |
CAB | SAX | sing | 1.81Å | 1.83Å | |
CAC | CAD | doub | 1.38Å | 1.41Å | Aromatic |
CAC | CAH | sing | 1.38Å | 1.43Å | Aromatic |
CAD | CAI | sing | 1.38Å | 1.42Å | Aromatic |
CAE | CAF | sing | 1.53Å | 1.45Å | |
CAE | CAG | sing | 1.53Å | 1.58Å | |
CAF | CAM | sing | 1.53Å | 1.50Å | |
CAG | CAP | sing | 1.53Å | 1.52Å | |
CAH | CAR | doub | 1.39Å | 1.44Å | Aromatic |
CAI | CAT | doub | 1.39Å | 1.42Å | Aromatic |
CAJ | CAK | doub | 1.38Å | 1.41Å | Aromatic |
CAJ | CAQ | sing | 1.39Å | 1.42Å | Aromatic |
CAK | CAU | sing | 1.39Å | 1.42Å | Aromatic |
CAL | CAN | sing | 1.53Å | 1.55Å | |
CAL | CAP | sing | 1.53Å | 1.54Å | |
CAM | NAV | sing | 1.47Å | 1.52Å | |
CAN | NAW | sing | 1.46Å | 1.49Å | |
CAO | CAQ | doub | 1.39Å | 1.42Å | Aromatic |
CAO | CAS | sing | 1.39Å | 1.43Å | Aromatic |
CAP | NAV | sing | 1.47Å | 1.48Å | |
CAQ | SAX | sing | 1.76Å | 1.79Å | |
CAR | CAT | sing | 1.39Å | 1.44Å | Aromatic |
CAR | NAW | sing | 1.39Å | 1.44Å | |
CAS | CAU | doub | 1.39Å | 1.44Å | Aromatic |
CAS | NAW | sing | 1.39Å | 1.45Å | |
CAT | SAY | sing | 1.76Å | 1.82Å | |
CAU | SAY | sing | 1.76Å | 1.79Å | |
CAA | HAA | sing | 1.09Å | 1.10Å | |
CAA | HAAA | sing | 1.09Å | 1.10Å | |
CAA | HAAB | sing | 1.09Å | 1.10Å | |
CAB | HAB | sing | 1.09Å | 1.10Å | |
CAB | HABA | sing | 1.09Å | 1.10Å | |
CAB | HABB | sing | 1.09Å | 1.10Å | |
CAC | HAC | sing | 1.08Å | 1.08Å | |
CAD | HAD | sing | 1.08Å | 1.08Å | |
CAE | HAE | sing | 1.09Å | 1.10Å | |
CAE | HAEA | sing | 1.09Å | 1.10Å | |
CAF | HAF | sing | 1.09Å | 1.10Å | |
CAF | HAFA | sing | 1.09Å | 1.10Å | |
CAG | HAG | sing | 1.09Å | 1.10Å | |
CAG | HAGA | sing | 1.09Å | 1.10Å | |
CAH | HAH | sing | 1.08Å | 1.08Å | |
CAI | HAI | sing | 1.08Å | 1.08Å | |
CAJ | HAJ | sing | 1.08Å | 1.08Å | |
CAK | HAK | sing | 1.08Å | 1.08Å | |
CAL | HAL | sing | 1.09Å | 1.10Å | |
CAL | HALA | sing | 1.09Å | 1.10Å | |
CAM | HAM | sing | 1.09Å | 1.10Å | |
CAM | HAMA | sing | 1.09Å | 1.10Å | |
CAN | HAN | sing | 1.09Å | 1.10Å | |
CAN | HANA | sing | 1.09Å | 1.10Å | |
CAO | HAO | sing | 1.08Å | 1.08Å | |
CAP | HAP | sing | 1.09Å | 1.10Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
CAA | NAV | CAM | 103.7° | 111.0° |
CAA | NAV | CAP | 113.6° | 111.0° |
NAV | CAA | HAA | 109.5° | 109.4° |
NAV | CAA | HAAA | 109.5° | 109.4° |
NAV | CAA | HAAB | 109.5° | 109.5° |
CAB | SAX | CAQ | 106.0° | 103.0° |
SAX | CAB | HAB | 109.5° | 109.4° |
SAX | CAB | HABA | 109.5° | 109.5° |
SAX | CAB | HABB | 109.4° | 109.5° |
CAD | CAC | CAH | 120.8° | 120.2° |
CAC | CAD | CAI | 119.7° | 120.0° |
CAD | CAC | HAC | 119.6° | 119.9° |
CAC | CAD | HAD | 120.1° | 120.0° |
CAC | CAH | CAR | 119.8° | 120.3° |
CAH | CAC | HAC | 119.6° | 119.9° |
CAC | CAH | HAH | 120.1° | 119.9° |
CAD | CAI | CAT | 120.5° | 120.2° |
CAI | CAD | HAD | 120.2° | 120.1° |
CAD | CAI | HAI | 119.8° | 119.9° |
CAF | CAE | CAG | 109.2° | 109.2° |
CAE | CAF | CAM | 109.0° | 109.3° |
CAF | CAE | HAE | 109.6° | 109.5° |
CAF | CAE | HAEA | 109.5° | 109.5° |
CAE | CAF | HAF | 109.6° | 109.5° |
CAE | CAF | HAFA | 109.6° | 109.5° |
CAE | CAG | CAP | 111.0° | 109.3° |
CAG | CAE | HAE | 109.5° | 109.5° |
CAG | CAE | HAEA | 109.5° | 109.6° |
CAE | CAG | HAG | 109.0° | 109.6° |
CAE | CAG | HAGA | 109.0° | 109.5° |
CAF | CAM | NAV | 111.1° | 109.6° |
CAM | CAF | HAF | 109.6° | 109.5° |
CAM | CAF | HAFA | 109.7° | 109.5° |
CAF | CAM | HAM | 108.9° | 109.4° |
CAF | CAM | HAMA | 108.9° | 109.5° |
CAG | CAP | CAL | 107.9° | 109.5° |
CAG | CAP | NAV | 109.4° | 109.5° |
CAP | CAG | HAG | 108.9° | 109.5° |
CAP | CAG | HAGA | 109.0° | 109.5° |
CAG | CAP | HAP | 111.5° | 109.5° |
CAH | CAR | CAT | 118.8° | 119.4° |
CAH | CAR | NAW | 122.3° | 118.8° |
CAR | CAH | HAH | 120.1° | 119.8° |
CAI | CAT | CAR | 120.4° | 120.0° |
CAI | CAT | SAY | 118.7° | 119.4° |
CAT | CAI | HAI | 119.8° | 119.9° |
CAK | CAJ | CAQ | 118.8° | 119.9° |
CAJ | CAK | CAU | 120.8° | 120.3° |
CAK | CAJ | HAJ | 120.6° | 120.1° |
CAJ | CAK | HAK | 119.6° | 119.8° |
CAJ | CAQ | CAO | 121.2° | 120.0° |
CAJ | CAQ | SAX | 120.0° | 120.0° |
CAQ | CAJ | HAJ | 120.6° | 120.0° |
CAK | CAU | CAS | 120.7° | 120.1° |
CAK | CAU | SAY | 119.4° | 119.3° |
CAU | CAK | HAK | 119.6° | 119.8° |
CAN | CAL | CAP | 109.5° | 109.5° |
CAL | CAN | NAW | 120.7° | 109.5° |
CAN | CAL | HAL | 109.5° | 109.4° |
CAN | CAL | HALA | 109.5° | 109.5° |
CAL | CAN | HAN | 105.9° | 109.5° |
CAL | CAN | HANA | 105.9° | 109.5° |
CAL | CAP | NAV | 112.3° | 109.4° |
CAP | CAL | HAL | 109.4° | 109.4° |
CAP | CAL | HALA | 109.5° | 109.5° |
CAL | CAP | HAP | 108.6° | 109.4° |
CAM | NAV | CAP | 113.2° | 111.2° |
NAV | CAM | HAM | 109.0° | 109.5° |
NAV | CAM | HAMA | 108.9° | 109.4° |
CAN | NAW | CAR | 119.2° | 117.9° |
CAN | NAW | CAS | 122.0° | 117.9° |
NAW | CAN | HAN | 105.9° | 109.5° |
NAW | CAN | HANA | 105.9° | 109.5° |
CAQ | CAO | CAS | 120.3° | 120.3° |
CAO | CAQ | SAX | 118.8° | 120.0° |
CAQ | CAO | HAO | 119.8° | 119.9° |
CAO | CAS | CAU | 118.1° | 119.4° |
CAO | CAS | NAW | 121.3° | 118.7° |
CAS | CAO | HAO | 119.8° | 119.9° |
NAV | CAP | HAP | 107.2° | 109.5° |
CAT | CAR | NAW | 118.9° | 121.8° |
CAR | CAT | SAY | 120.9° | 120.6° |
CAR | NAW | CAS | 118.5° | 124.3° |
CAU | CAS | NAW | 120.7° | 121.8° |
CAS | CAU | SAY | 119.9° | 120.6° |
CAT | SAY | CAU | 99.1° | 103.4° |
HAA | CAA | HAAA | 109.5° | 109.5° |
HAA | CAA | HAAB | 109.5° | 109.5° |
HAAA | CAA | HAAB | 109.5° | 109.6° |
HAB | CAB | HABA | 109.4° | 109.5° |
HAB | CAB | HABB | 109.5° | 109.5° |
HABA | CAB | HABB | 109.5° | 109.5° |
HAE | CAE | HAEA | 109.4° | 109.6° |
HAF | CAF | HAFA | 109.3° | 109.5° |
HAG | CAG | HAGA | 110.0° | 109.5° |
HAL | CAL | HALA | 109.5° | 109.5° |
HAM | CAM | HAMA | 110.0° | 109.5° |
HAN | CAN | HANA | 112.8° | 109.4° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
CAA | NAV | CAM | CAF | 179.9° | 174.2° |
CAA | NAV | CAP | CAG | 170.4° | 174.2° |
CAA | NAV | CAP | CAL | 69.8° | 54.2° |
CAA | NAV | CAM | CAP | 123.6° | 124.1° |
NAV | CAA | HAA | HAAA | 120.0° | 119.9° |
NAV | CAA | HAA | HAAB | 120.0° | 120.0° |
NAV | CAA | HAAA | HAAB | 120.0° | 120.0° |
CAA | NAV | CAM | HAM | 60.2° | 65.8° |
CAA | NAV | CAM | HAMA | 59.8° | 54.2° |
CAA | NAV | CAP | HAP | 49.4° | 65.8° |
CAB | SAX | CAQ | CAJ | 50.3° | 0.0° |
CAB | SAX | CAQ | CAO | 129.5° | 180.0° |
SAX | CAB | HAB | HABA | 120.0° | 120.0° |
SAX | CAB | HAB | HABB | 120.0° | 120.0° |
SAX | CAB | HABA | HABB | 120.0° | 120.0° |
CAD | CAC | CAH | HAC | 180.0° | 179.7° |
CAC | CAD | CAI | HAD | 180.0° | 180.0° |
CAD | CAC | CAH | CAR | 0.0° | 0.0° |
CAC | CAD | CAI | CAT | 0.1° | 0.0° |
CAD | CAC | CAH | HAH | 180.0° | 180.0° |
CAC | CAD | CAI | HAI | 179.9° | 179.9° |
CAH | CAC | CAD | CAI | 0.1° | 0.1° |
CAC | CAH | CAR | HAH | 180.0° | 180.0° |
CAC | CAH | CAR | CAT | 0.1° | 0.1° |
CAC | CAH | CAR | NAW | 179.8° | 179.7° |
CAH | CAC | CAD | HAD | 179.9° | 179.9° |
CAD | CAI | CAT | HAI | 180.0° | 179.9° |
CAD | CAI | CAT | CAR | 0.0° | 0.2° |
CAD | CAI | CAT | SAY | 179.8° | 179.7° |
CAI | CAD | CAC | HAC | 179.9° | 179.7° |
CAF | CAE | CAG | HAE | 120.0° | 119.9° |
CAF | CAE | CAG | HAEA | 120.0° | 119.9° |
CAE | CAF | CAM | HAF | 120.0° | 120.0° |
CAE | CAF | CAM | HAFA | 120.0° | 119.9° |
CAF | CAE | CAG | CAP | 59.3° | 57.7° |
CAE | CAF | CAM | NAV | 60.5° | 59.2° |
CAF | CAE | HAE | HAEA | 120.1° | 120.1° |
CAE | CAF | HAF | HAFA | 120.2° | 120.1° |
CAF | CAE | CAG | HAG | 60.7° | 62.3° |
CAF | CAE | CAG | HAGA | 179.3° | 177.6° |
CAE | CAF | CAM | HAM | 59.5° | 60.9° |
CAE | CAF | CAM | HAMA | 179.5° | 179.2° |
CAG | CAE | CAF | CAM | 61.3° | 57.6° |
CAE | CAG | CAP | HAG | 120.0° | 120.0° |
CAE | CAG | CAP | HAGA | 120.0° | 119.9° |
CAE | CAG | CAP | CAL | 175.7° | 179.2° |
CAE | CAG | CAP | NAV | 53.3° | 59.2° |
CAG | CAE | HAE | HAEA | 120.1° | 120.3° |
CAG | CAE | CAF | HAF | 178.7° | 177.6° |
CAG | CAE | CAF | HAFA | 58.7° | 62.2° |
CAE | CAG | HAG | HAGA | 119.4° | 120.1° |
CAE | CAG | CAP | HAP | 65.1° | 60.8° |
CAF | CAM | NAV | HAM | 120.0° | 120.0° |
CAF | CAM | NAV | HAMA | 120.0° | 120.0° |
CAF | CAM | NAV | CAP | 56.6° | 61.7° |
CAM | CAF | CAE | HAE | 178.7° | 177.5° |
CAM | CAF | CAE | HAEA | 58.7° | 62.3° |
CAM | CAF | HAF | HAFA | 120.2° | 120.1° |
CAF | CAM | HAM | HAMA | 119.3° | 120.0° |
CAG | CAP | CAL | CAN | 123.4° | 63.1° |
CAG | CAP | CAL | NAV | 120.7° | 120.1° |
CAG | CAP | CAL | HAP | 121.0° | 120.0° |
CAG | CAP | NAV | CAM | 52.5° | 61.8° |
CAG | CAP | NAV | HAP | 121.0° | 120.0° |
CAP | CAG | CAE | HAE | 179.3° | 177.5° |
CAP | CAG | CAE | HAEA | 60.7° | 62.2° |
CAP | CAG | HAG | HAGA | 119.3° | 120.1° |
CAG | CAP | CAL | HAL | 3.3° | 56.8° |
CAG | CAP | CAL | HALA | 116.6° | 176.8° |
CAH | CAR | CAT | CAI | 0.1° | 0.2° |
CAH | CAR | NAW | CAN | 33.9° | 25.2° |
CAH | CAR | CAT | NAW | 179.9° | 179.8° |
CAH | CAR | NAW | CAS | 139.3° | 154.8° |
CAH | CAR | CAT | SAY | 179.9° | 179.6° |
CAR | CAH | CAC | HAC | 180.0° | 179.7° |
CAI | CAT | CAR | SAY | 179.8° | 179.8° |
CAI | CAT | CAR | NAW | 179.8° | 179.6° |
CAI | CAT | SAY | CAU | 148.7° | 162.0° |
CAT | CAI | CAD | HAD | 179.9° | 180.0° |
CAK | CAJ | CAQ | HAJ | 180.0° | 180.0° |
CAJ | CAK | CAU | HAK | 180.0° | 179.9° |
CAK | CAJ | CAQ | CAO | 0.4° | 0.1° |
CAK | CAJ | CAQ | SAX | 179.5° | 179.9° |
CAJ | CAK | CAU | CAS | 0.2° | 0.1° |
CAJ | CAK | CAU | SAY | 179.6° | 179.6° |
CAQ | CAJ | CAK | CAU | 0.0° | 0.0° |
CAJ | CAQ | CAO | SAX | 179.9° | 180.0° |
CAJ | CAQ | CAO | CAS | 0.4° | 0.0° |
CAQ | CAJ | CAK | HAK | 180.0° | 179.9° |
CAJ | CAQ | CAO | HAO | 179.6° | 179.9° |
CAK | CAU | CAS | CAO | 0.2° | 0.2° |
CAK | CAU | CAS | SAY | 179.8° | 179.7° |
CAK | CAU | CAS | NAW | 179.9° | 179.6° |
CAK | CAU | SAY | CAT | 148.8° | 161.9° |
CAU | CAK | CAJ | HAJ | 179.9° | 180.0° |
CAN | CAL | CAP | HAL | 120.0° | 120.0° |
CAN | CAL | CAP | HALA | 120.0° | 120.0° |
CAL | CAN | NAW | HAN | 120.0° | 120.0° |
CAL | CAN | NAW | HANA | 120.0° | 120.0° |
CAN | CAL | CAP | NAV | 116.0° | 176.8° |
CAL | CAN | NAW | CAR | 138.8° | 90.5° |
CAL | CAN | NAW | CAS | 48.3° | 89.5° |
CAN | CAL | HAL | HALA | 120.0° | 120.0° |
CAL | CAN | HAN | HANA | 115.4° | 120.0° |
CAN | CAL | CAP | HAP | 2.3° | 56.8° |
CAL | CAP | NAV | CAM | 172.3° | 178.2° |
CAP | CAL | CAN | NAW | 131.7° | 177.1° |
CAL | CAP | NAV | HAP | 119.2° | 120.0° |
CAL | CAP | CAG | HAG | 55.7° | 59.2° |
CAL | CAP | CAG | HAGA | 64.3° | 60.8° |
CAP | CAL | HAL | HALA | 120.0° | 120.0° |
CAP | CAL | CAN | HAN | 11.7° | 57.1° |
CAP | CAL | CAN | HANA | 108.3° | 62.9° |
CAM | NAV | CAA | HAA | 180.0° | 53.8° |
CAM | NAV | CAA | HAAA | 60.0° | 173.8° |
CAM | NAV | CAA | HAAB | 60.0° | 66.2° |
NAV | CAM | CAF | HAF | 179.5° | 179.1° |
NAV | CAM | CAF | HAFA | 59.5° | 60.7° |
NAV | CAM | HAM | HAMA | 119.3° | 119.9° |
CAM | NAV | CAP | HAP | 68.5° | 58.3° |
CAN | NAW | CAS | CAO | 34.1° | 25.2° |
CAN | NAW | CAR | CAT | 146.0° | 154.6° |
CAN | NAW | CAR | CAS | 173.2° | 180.0° |
CAN | NAW | CAS | CAU | 145.7° | 154.6° |
NAW | CAN | CAL | HAL | 11.7° | 57.1° |
NAW | CAN | CAL | HALA | 108.3° | 62.9° |
NAW | CAN | HAN | HANA | 115.4° | 120.0° |
CAQ | CAO | CAS | HAO | 180.0° | 179.9° |
CAQ | CAO | CAS | CAU | 0.1° | 0.1° |
CAQ | CAO | CAS | NAW | 179.7° | 179.7° |
CAO | CAQ | CAJ | HAJ | 179.6° | 179.9° |
CAS | CAO | CAQ | SAX | 179.5° | 180.0° |
CAO | CAS | NAW | CAR | 138.8° | 154.8° |
CAO | CAS | CAU | NAW | 179.9° | 179.7° |
CAO | CAS | CAU | SAY | 179.6° | 179.6° |
CAP | NAV | CAA | HAA | 56.7° | 178.0° |
CAP | NAV | CAA | HAAA | 63.3° | 62.1° |
CAP | NAV | CAA | HAAB | 176.8° | 58.0° |
NAV | CAP | CAG | HAG | 66.7° | 60.8° |
NAV | CAP | CAG | HAGA | 173.3° | 179.2° |
NAV | CAP | CAL | HAL | 124.0° | 63.2° |
NAV | CAP | CAL | HALA | 4.0° | 56.8° |
CAP | NAV | CAM | HAM | 63.4° | 58.3° |
CAP | NAV | CAM | HAMA | 176.6° | 178.2° |
CAQ | SAX | CAB | HAB | 180.0° | 60.0° |
CAQ | SAX | CAB | HABA | 60.0° | 60.0° |
CAQ | SAX | CAB | HABB | 60.0° | 180.0° |
SAX | CAQ | CAJ | HAJ | 0.5° | 0.1° |
SAX | CAQ | CAO | HAO | 0.6° | 0.1° |
CAT | CAR | NAW | CAS | 40.8° | 25.4° |
CAR | CAT | SAY | CAU | 31.6° | 17.8° |
CAT | CAR | CAH | HAH | 179.9° | 179.9° |
CAR | CAT | CAI | HAI | 180.0° | 179.7° |
CAR | NAW | CAS | CAU | 41.3° | 25.5° |
NAW | CAR | CAT | SAY | 0.0° | 0.6° |
NAW | CAR | CAH | HAH | 0.2° | 0.3° |
CAR | NAW | CAN | HAN | 101.2° | 149.5° |
CAR | NAW | CAN | HANA | 18.8° | 29.5° |
CAS | CAU | SAY | CAT | 31.3° | 17.8° |
CAS | CAU | CAK | HAK | 179.7° | 179.8° |
CAU | CAS | CAO | HAO | 179.9° | 180.0° |
NAW | CAS | CAU | SAY | 0.2° | 0.7° |
CAS | NAW | CAN | HAN | 71.7° | 30.5° |
CAS | NAW | CAN | HANA | 168.3° | 150.5° |
NAW | CAS | CAO | HAO | 0.3° | 0.3° |
SAY | CAT | CAI | HAI | 0.2° | 0.4° |
SAY | CAU | CAK | HAK | 0.4° | 0.5° |
HAA | CAA | HAAA | HAAB | 120.0° | 120.1° |
HAB | CAB | HABA | HABB | 120.0° | 120.0° |
HAC | CAC | CAD | HAD | 0.1° | 0.3° |
HAC | CAC | CAH | HAH | 0.0° | 0.3° |
HAD | CAD | CAI | HAI | 0.1° | 0.1° |
HAE | CAE | CAF | HAF | 58.7° | 62.5° |
HAE | CAE | CAF | HAFA | 61.3° | 57.7° |
HAE | CAE | CAG | HAG | 59.4° | 57.5° |
HAE | CAE | CAG | HAGA | 60.6° | 62.5° |
HAEA | CAE | CAF | HAF | 61.3° | 57.7° |
HAEA | CAE | CAF | HAFA | 178.7° | 177.8° |
HAEA | CAE | CAG | HAG | 179.4° | 177.8° |
HAEA | CAE | CAG | HAGA | 59.4° | 57.7° |
HAF | CAF | CAM | HAM | 60.5° | 59.1° |
HAF | CAF | CAM | HAMA | 59.5° | 60.9° |
HAFA | CAF | CAM | HAM | 179.5° | 179.3° |
HAFA | CAF | CAM | HAMA | 60.5° | 59.3° |
HAG | CAG | CAP | HAP | 174.9° | 179.2° |
HAGA | CAG | CAP | HAP | 54.9° | 59.1° |
HAJ | CAJ | CAK | HAK | 0.0° | 0.1° |
HAL | CAL | CAN | HAN | 108.3° | 62.9° |
HAL | CAL | CAN | HANA | 131.7° | 177.2° |
HAL | CAL | CAP | HAP | 117.7° | 176.8° |
HALA | CAL | CAN | HAN | 131.7° | 177.1° |
HALA | CAL | CAN | HANA | 11.7° | 57.1° |
HALA | CAL | CAP | HAP | 122.3° | 63.2° |