G24
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
CAF | CAB | doub | 1.38Å | 1.41Å | Aromatic |
CAF | CAG | sing | 1.38Å | 1.41Å | Aromatic |
CAF | HAF | sing | 1.08Å | 1.10Å | |
CAB | CAC | sing | 1.38Å | 1.41Å | Aromatic |
CAB | HAB | sing | 1.08Å | 1.10Å | |
CAC | CAD | doub | 1.38Å | 1.41Å | Aromatic |
CAC | HAC | sing | 1.08Å | 1.10Å | |
CAD | CAH | sing | 1.38Å | 1.41Å | Aromatic |
CAD | HAD | sing | 1.08Å | 1.10Å | |
CAH | CAG | doub | 1.38Å | 1.41Å | Aromatic |
CAH | HAH | sing | 1.08Å | 1.10Å | |
CAG | CAQ | sing | 1.51Å | 1.54Å | |
CAQ | CAP | sing | 1.51Å | 1.53Å | |
CAQ | HAQ1 | sing | 1.09Å | 1.11Å | |
CAQ | HAQ2 | sing | 1.09Å | 1.11Å | |
CAP | CAO | doub | 1.38Å | 1.41Å | Aromatic |
CAP | CBA | sing | 1.39Å | 1.39Å | Aromatic |
CAO | CAN | sing | 1.38Å | 1.41Å | Aromatic |
CAO | HAO | sing | 1.08Å | 1.10Å | |
CBA | OBC | sing | 1.36Å | 1.36Å | |
CBA | CAZ | doub | 1.39Å | 1.41Å | Aromatic |
OBC | HBC | sing | 0.97Å | 0.95Å | |
CAZ | CAY | sing | 1.38Å | 1.42Å | Aromatic |
CAZ | HAZ | sing | 1.08Å | 1.10Å | |
CAY | CAN | doub | 1.38Å | 1.41Å | Aromatic |
CAY | HAY | sing | 1.08Å | 1.10Å | |
CAN | CAM | sing | 1.51Å | 1.56Å | |
CAM | CAL | sing | 1.51Å | 1.55Å | |
CAM | HAM1 | sing | 1.09Å | 1.11Å | |
CAM | HAM2 | sing | 1.09Å | 1.12Å | |
CAL | CAX | doub | 1.38Å | 1.42Å | Aromatic |
CAL | CAK | sing | 1.38Å | 1.43Å | Aromatic |
CAX | CBB | sing | 1.51Å | 1.53Å | |
CAX | CAW | sing | 1.38Å | 1.40Å | Aromatic |
CBB | HBB1 | sing | 1.09Å | 1.11Å | |
CBB | HBB2 | sing | 1.09Å | 1.12Å | |
CBB | HBB3 | sing | 1.09Å | 1.11Å | |
CAW | CAV | doub | 1.39Å | 1.41Å | Aromatic |
CAW | HAW | sing | 1.08Å | 1.10Å | |
CAK | CAE | sing | 1.51Å | 1.54Å | |
CAK | CAJ | doub | 1.38Å | 1.41Å | Aromatic |
CAE | HAE1 | sing | 1.09Å | 1.11Å | |
CAE | HAE2 | sing | 1.09Å | 1.12Å | |
CAE | HAE3 | sing | 1.09Å | 1.11Å | |
CAJ | CAV | sing | 1.39Å | 1.39Å | Aromatic |
CAJ | HAJ | sing | 1.08Å | 1.10Å | |
CAV | OAU | sing | 1.36Å | 1.37Å | |
OAU | CAT | sing | 1.43Å | 1.45Å | |
CAT | CAS | sing | 1.51Å | 1.52Å | |
CAT | HAT1 | sing | 1.09Å | 1.12Å | |
CAT | HAT2 | sing | 1.09Å | 1.11Å | |
CAS | OAR | sing | 1.34Å | 1.25Å | |
CAS | OAI | doub | 1.21Å | 1.25Å | |
OAR | HAR | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
CAB | CAF | CAG | 120.2° | 120.0° |
CAB | CAF | HAF | 120.0° | 120.0° |
CAF | CAB | CAC | 120.3° | 120.0° |
CAF | CAB | HAB | 120.0° | 120.0° |
CAG | CAF | HAF | 119.8° | 120.0° |
CAF | CAG | CAH | 119.8° | 120.0° |
CAF | CAG | CAQ | 119.5° | 120.0° |
CAC | CAB | HAB | 119.8° | 119.9° |
CAB | CAC | CAD | 119.7° | 119.9° |
CAB | CAC | HAC | 120.1° | 120.0° |
CAD | CAC | HAC | 120.2° | 120.0° |
CAC | CAD | CAH | 120.2° | 120.0° |
CAC | CAD | HAD | 119.8° | 120.0° |
CAH | CAD | HAD | 120.0° | 120.0° |
CAD | CAH | CAG | 119.8° | 120.0° |
CAD | CAH | HAH | 120.1° | 120.0° |
CAG | CAH | HAH | 120.1° | 120.0° |
CAH | CAG | CAQ | 120.6° | 120.0° |
CAG | CAQ | CAP | 107.7° | 109.4° |
CAG | CAQ | HAQ1 | 112.9° | 109.5° |
CAG | CAQ | HAQ2 | 112.9° | 109.4° |
CAP | CAQ | HAQ1 | 112.9° | 109.5° |
CAP | CAQ | HAQ2 | 112.9° | 109.4° |
CAQ | CAP | CAO | 118.1° | 120.1° |
CAQ | CAP | CBA | 122.6° | 120.0° |
HAQ1 | CAQ | HAQ2 | 97.6° | 109.5° |
CAO | CAP | CBA | 119.3° | 119.9° |
CAP | CAO | CAN | 121.1° | 120.1° |
CAP | CAO | HAO | 119.4° | 120.0° |
CAP | CBA | OBC | 118.2° | 120.0° |
CAP | CBA | CAZ | 120.6° | 119.9° |
CAN | CAO | HAO | 119.5° | 120.0° |
CAO | CAN | CAY | 119.5° | 120.1° |
CAO | CAN | CAM | 117.7° | 119.9° |
OBC | CBA | CAZ | 121.2° | 120.1° |
CBA | OBC | HBC | 118.2° | 106.8° |
CBA | CAZ | CAY | 120.1° | 120.0° |
CBA | CAZ | HAZ | 119.8° | 120.0° |
CAY | CAZ | HAZ | 120.1° | 120.0° |
CAZ | CAY | CAN | 119.4° | 120.0° |
CAZ | CAY | HAY | 120.7° | 120.0° |
CAN | CAY | HAY | 119.9° | 120.0° |
CAY | CAN | CAM | 122.8° | 119.9° |
CAN | CAM | CAL | 114.9° | 109.5° |
CAN | CAM | HAM1 | 110.2° | 109.4° |
CAN | CAM | HAM2 | 110.2° | 109.5° |
CAL | CAM | HAM1 | 110.2° | 109.5° |
CAL | CAM | HAM2 | 110.2° | 109.5° |
CAM | CAL | CAX | 121.2° | 119.9° |
CAM | CAL | CAK | 121.7° | 120.0° |
HAM1 | CAM | HAM2 | 100.0° | 109.5° |
CAX | CAL | CAK | 117.2° | 120.1° |
CAL | CAX | CBB | 120.5° | 120.0° |
CAL | CAX | CAW | 121.1° | 120.0° |
CAL | CAK | CAE | 120.4° | 120.0° |
CAL | CAK | CAJ | 121.1° | 120.1° |
CBB | CAX | CAW | 118.4° | 120.0° |
CAX | CBB | HBB1 | 108.2° | 109.5° |
CAX | CBB | HBB2 | 120.5° | 109.5° |
CAX | CBB | HBB3 | 108.3° | 109.5° |
CAX | CAW | CAV | 120.8° | 119.9° |
CAX | CAW | HAW | 119.3° | 120.0° |
HBB1 | CBB | HBB2 | 108.3° | 109.5° |
HBB1 | CBB | HBB3 | 101.7° | 109.5° |
HBB2 | CBB | HBB3 | 108.2° | 109.5° |
CAV | CAW | HAW | 119.9° | 120.1° |
CAW | CAV | CAJ | 119.2° | 119.9° |
CAW | CAV | OAU | 121.7° | 120.0° |
CAE | CAK | CAJ | 118.5° | 120.0° |
CAK | CAE | HAE1 | 108.3° | 109.5° |
CAK | CAE | HAE2 | 120.3° | 109.5° |
CAK | CAE | HAE3 | 108.3° | 109.4° |
CAK | CAJ | CAV | 120.6° | 119.9° |
CAK | CAJ | HAJ | 120.3° | 120.0° |
HAE1 | CAE | HAE2 | 108.3° | 109.5° |
HAE1 | CAE | HAE3 | 101.6° | 109.5° |
HAE2 | CAE | HAE3 | 108.4° | 109.4° |
CAV | CAJ | HAJ | 119.1° | 120.0° |
CAJ | CAV | OAU | 119.1° | 120.1° |
CAV | OAU | CAT | 112.2° | 106.8° |
OAU | CAT | CAS | 110.3° | 109.5° |
OAU | CAT | HAT1 | 111.9° | 109.5° |
OAU | CAT | HAT2 | 111.9° | 109.4° |
CAS | CAT | HAT1 | 111.9° | 109.5° |
CAS | CAT | HAT2 | 111.9° | 109.4° |
CAT | CAS | OAR | 118.0° | 120.0° |
CAT | CAS | OAI | 117.6° | 120.0° |
HAT1 | CAT | HAT2 | 98.5° | 109.4° |
OAR | CAS | OAI | 124.5° | 120.0° |
CAS | OAR | HAR | 117.9° | 120.1° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
CAB | CAF | CAG | HAF | 180.0° | 180.0° |
CAF | CAB | CAC | HAB | 180.0° | 180.0° |
CAF | CAB | CAC | CAD | 0.2° | 0.0° |
CAF | CAB | CAC | HAC | 179.8° | 179.9° |
CAB | CAF | CAG | CAH | 0.2° | 0.2° |
CAB | CAF | CAG | CAQ | 179.3° | 180.0° |
CAG | CAF | CAB | CAC | 0.2° | 0.0° |
CAG | CAF | CAB | HAB | 179.8° | 180.0° |
CAF | CAG | CAH | CAD | 0.1° | 0.5° |
CAF | CAG | CAH | CAQ | 179.4° | 179.7° |
CAF | CAG | CAH | HAH | 179.9° | 180.0° |
CAF | CAG | CAQ | CAP | 93.7° | 90.0° |
CAF | CAG | CAQ | HAQ1 | 141.0° | 30.0° |
CAF | CAG | CAQ | HAQ2 | 31.6° | 150.0° |
HAF | CAF | CAB | CAC | 179.8° | 180.0° |
HAF | CAF | CAB | HAB | 0.2° | 0.0° |
HAF | CAF | CAG | CAH | 179.8° | 179.8° |
HAF | CAF | CAG | CAQ | 0.7° | 0.0° |
CAB | CAC | CAD | HAC | 180.0° | 180.0° |
CAB | CAC | CAD | CAH | 0.2° | 0.2° |
CAB | CAC | CAD | HAD | 179.9° | 180.0° |
HAB | CAB | CAC | CAD | 179.8° | 180.0° |
HAB | CAB | CAC | HAC | 0.2° | 0.1° |
CAC | CAD | CAH | HAD | 180.0° | 179.8° |
CAC | CAD | CAH | CAG | 0.2° | 0.4° |
CAC | CAD | CAH | HAH | 179.9° | 180.0° |
HAC | CAC | CAD | CAH | 179.8° | 179.9° |
HAC | CAC | CAD | HAD | 0.1° | 0.0° |
CAD | CAH | CAG | HAH | 180.0° | 179.5° |
CAD | CAH | CAG | CAQ | 179.3° | 179.8° |
HAD | CAD | CAH | CAG | 179.9° | 179.7° |
HAD | CAD | CAH | HAH | 0.1° | 0.2° |
CAH | CAG | CAQ | CAP | 85.7° | 90.2° |
CAH | CAG | CAQ | HAQ1 | 39.6° | 149.7° |
CAH | CAG | CAQ | HAQ2 | 149.0° | 29.7° |
HAH | CAH | CAG | CAQ | 0.7° | 0.3° |
CAG | CAQ | CAP | HAQ1 | 125.3° | 120.0° |
CAG | CAQ | CAP | HAQ2 | 125.3° | 119.9° |
CAG | CAQ | HAQ1 | HAQ2 | 118.8° | 120.0° |
CAG | CAQ | CAP | CAO | 91.8° | 90.3° |
CAG | CAQ | CAP | CBA | 86.3° | 90.1° |
CAP | CAQ | HAQ1 | HAQ2 | 118.8° | 120.0° |
CAQ | CAP | CAO | CBA | 178.1° | 179.7° |
CAQ | CAP | CAO | CAN | 177.7° | 179.8° |
CAQ | CAP | CAO | HAO | 2.3° | 0.3° |
CAQ | CAP | CBA | OBC | 3.1° | 0.0° |
CAQ | CAP | CBA | CAZ | 177.4° | 180.0° |
HAQ1 | CAQ | CAP | CAO | 142.9° | 149.7° |
HAQ1 | CAQ | CAP | CBA | 39.0° | 29.9° |
HAQ2 | CAQ | CAP | CAO | 33.5° | 29.6° |
HAQ2 | CAQ | CAP | CBA | 148.5° | 150.0° |
CAP | CAO | CAN | HAO | 180.0° | 179.4° |
CAO | CAP | CBA | OBC | 178.8° | 179.7° |
CAO | CAP | CBA | CAZ | 0.7° | 0.3° |
CAP | CAO | CAN | CAY | 0.0° | 0.6° |
CAP | CAO | CAN | CAM | 177.7° | 179.7° |
CBA | CAP | CAO | CAN | 0.4° | 0.6° |
CBA | CAP | CAO | HAO | 179.6° | 180.0° |
CAP | CBA | OBC | CAZ | 179.5° | 180.0° |
CAP | CBA | OBC | HBC | 180.0° | 90.0° |
CAP | CBA | CAZ | CAY | 0.5° | 0.0° |
CAP | CBA | CAZ | HAZ | 179.5° | 180.0° |
CAO | CAN | CAY | CAZ | 0.2° | 0.3° |
CAO | CAN | CAY | CAM | 177.6° | 179.7° |
CAO | CAN | CAY | HAY | 179.8° | 179.7° |
CAO | CAN | CAM | CAL | 141.3° | 87.9° |
CAO | CAN | CAM | HAM1 | 93.4° | 152.1° |
CAO | CAN | CAM | HAM2 | 16.1° | 32.1° |
HAO | CAO | CAN | CAY | 180.0° | 180.0° |
HAO | CAO | CAN | CAM | 2.3° | 0.3° |
OBC | CBA | CAZ | CAY | 179.0° | 180.0° |
OBC | CBA | CAZ | HAZ | 1.0° | 0.0° |
CAZ | CBA | OBC | HBC | 0.5° | 90.0° |
CBA | CAZ | CAY | HAZ | 180.0° | 180.0° |
CBA | CAZ | CAY | CAN | 0.1° | 0.1° |
CBA | CAZ | CAY | HAY | 179.9° | 180.0° |
CAZ | CAY | CAN | HAY | 180.0° | 180.0° |
CAZ | CAY | CAN | CAM | 177.4° | 180.0° |
HAZ | CAZ | CAY | CAN | 180.0° | 180.0° |
HAZ | CAZ | CAY | HAY | 0.0° | 0.0° |
CAY | CAN | CAM | CAL | 41.0° | 92.4° |
CAY | CAN | CAM | HAM1 | 84.3° | 27.6° |
CAY | CAN | CAM | HAM2 | 166.2° | 147.6° |
HAY | CAY | CAN | CAM | 2.6° | 0.0° |
CAN | CAM | CAL | HAM1 | 125.3° | 120.0° |
CAN | CAM | CAL | HAM2 | 125.2° | 120.0° |
CAN | CAM | HAM1 | HAM2 | 116.1° | 120.0° |
CAN | CAM | CAL | CAX | 102.4° | 96.1° |
CAN | CAM | CAL | CAK | 78.5° | 84.4° |
CAL | CAM | HAM1 | HAM2 | 116.1° | 120.0° |
CAM | CAL | CAX | CAK | 179.1° | 179.5° |
CAM | CAL | CAX | CBB | 0.5° | 0.3° |
CAM | CAL | CAX | CAW | 179.0° | 180.0° |
CAM | CAL | CAK | CAE | 1.4° | 0.3° |
CAM | CAL | CAK | CAJ | 178.9° | 180.0° |
HAM1 | CAM | CAL | CAX | 22.8° | 23.9° |
HAM1 | CAM | CAL | CAK | 156.2° | 155.6° |
HAM2 | CAM | CAL | CAX | 132.3° | 143.9° |
HAM2 | CAM | CAL | CAK | 46.7° | 35.6° |
CAL | CAX | CBB | CAW | 179.6° | 179.7° |
CAL | CAX | CBB | HBB1 | 54.7° | 95.8° |
CAL | CAX | CBB | HBB2 | 180.0° | 24.2° |
CAL | CAX | CBB | HBB3 | 54.7° | 144.2° |
CAL | CAX | CAW | CAV | 0.0° | 0.3° |
CAL | CAX | CAW | HAW | 180.0° | 179.7° |
CAX | CAL | CAK | CAE | 179.6° | 179.7° |
CAX | CAL | CAK | CAJ | 0.1° | 0.5° |
CAK | CAL | CAX | CBB | 179.6° | 179.7° |
CAK | CAL | CAX | CAW | 0.1° | 0.5° |
CAL | CAK | CAE | CAJ | 179.7° | 179.7° |
CAL | CAK | CAE | HAE1 | 54.7° | 89.7° |
CAL | CAK | CAE | HAE2 | 180.0° | 30.4° |
CAL | CAK | CAE | HAE3 | 54.7° | 150.2° |
CAL | CAK | CAJ | CAV | 0.2° | 0.2° |
CAL | CAK | CAJ | HAJ | 179.8° | 179.8° |
CAX | CBB | HBB1 | HBB2 | 132.2° | 120.0° |
CAX | CBB | HBB1 | HBB3 | 113.9° | 120.0° |
CAX | CBB | HBB2 | HBB3 | 125.3° | 120.0° |
CBB | CAX | CAW | CAV | 179.6° | 180.0° |
CBB | CAX | CAW | HAW | 0.4° | 0.0° |
CAW | CAX | CBB | HBB1 | 125.7° | 84.5° |
CAW | CAX | CBB | HBB2 | 0.4° | 155.5° |
CAW | CAX | CBB | HBB3 | 124.9° | 35.5° |
CAX | CAW | CAV | HAW | 180.0° | 180.0° |
CAX | CAW | CAV | CAJ | 0.0° | 0.0° |
CAX | CAW | CAV | OAU | 179.5° | 180.0° |
HBB1 | CBB | HBB2 | HBB3 | 109.5° | 120.0° |
CAW | CAV | CAJ | CAK | 0.1° | 0.0° |
CAW | CAV | CAJ | OAU | 179.6° | 180.0° |
CAW | CAV | CAJ | HAJ | 179.9° | 180.0° |
CAW | CAV | OAU | CAT | 32.7° | 180.0° |
HAW | CAW | CAV | CAJ | 180.0° | 180.0° |
HAW | CAW | CAV | OAU | 0.4° | 0.0° |
CAK | CAE | HAE1 | HAE2 | 132.1° | 120.0° |
CAK | CAE | HAE1 | HAE3 | 113.9° | 120.0° |
CAK | CAE | HAE2 | HAE3 | 125.3° | 119.9° |
CAE | CAK | CAJ | CAV | 179.5° | 180.0° |
CAE | CAK | CAJ | HAJ | 0.5° | 0.0° |
CAJ | CAK | CAE | HAE1 | 125.6° | 90.0° |
CAJ | CAK | CAE | HAE2 | 0.3° | 149.9° |
CAJ | CAK | CAE | HAE3 | 125.0° | 30.1° |
CAK | CAJ | CAV | HAJ | 180.0° | 180.0° |
CAK | CAJ | CAV | OAU | 179.5° | 180.0° |
HAE1 | CAE | HAE2 | HAE3 | 109.5° | 120.1° |
CAJ | CAV | OAU | CAT | 147.7° | 0.0° |
HAJ | CAJ | CAV | OAU | 0.5° | 0.0° |
CAV | OAU | CAT | CAS | 174.0° | 180.0° |
CAV | OAU | CAT | HAT1 | 48.7° | 59.9° |
CAV | OAU | CAT | HAT2 | 60.8° | 60.1° |
OAU | CAT | CAS | HAT1 | 125.3° | 120.1° |
OAU | CAT | CAS | HAT2 | 125.3° | 119.9° |
OAU | CAT | HAT1 | HAT2 | 117.9° | 119.9° |
OAU | CAT | CAS | OAR | 65.2° | 180.0° |
OAU | CAT | CAS | OAI | 114.9° | 0.1° |
CAS | CAT | HAT1 | HAT2 | 117.8° | 120.0° |
CAT | CAS | OAR | OAI | 179.9° | 179.9° |
CAT | CAS | OAR | HAR | 180.0° | 180.0° |
HAT1 | CAT | CAS | OAR | 60.1° | 59.8° |
HAT1 | CAT | CAS | OAI | 119.8° | 120.0° |
HAT2 | CAT | CAS | OAR | 169.6° | 60.1° |
HAT2 | CAT | CAS | OAI | 10.3° | 120.0° |
OAI | CAS | OAR | HAR | 0.1° | 0.1° |