G9L
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
CAM | N11 | sing | 1.47Å | 1.50Å | |
N11 | CAL | sing | 1.47Å | 1.48Å | |
N11 | CAN | sing | 1.47Å | 1.48Å | |
CAR | N12 | sing | 1.35Å | 1.36Å | |
N12 | CAO | sing | 1.47Å | 1.46Å | |
N12 | CAP | sing | 1.47Å | 1.45Å | |
CAT | N13 | sing | 1.38Å | 1.40Å | |
N13 | CAV | sing | 1.34Å | 1.35Å | |
N13 | HN13 | sing | 0.97Å | 1.00Å | |
OAA | CAR | doub | 1.21Å | 1.23Å | |
CAV | OAB | doub | 1.22Å | 1.25Å | |
CAS | FAC | sing | 1.35Å | 1.34Å | |
CAE | CAD | doub | 1.37Å | 1.39Å | Aromatic |
CAD | CAS | sing | 1.39Å | 1.40Å | Aromatic |
CAD | HAD | sing | 1.08Å | 1.08Å | |
CAE | CAW | sing | 1.40Å | 1.39Å | Aromatic |
CAE | HAE | sing | 1.08Å | 1.08Å | |
CAX | CAF | sing | 1.39Å | 1.39Å | Aromatic |
CAS | CAF | doub | 1.38Å | 1.41Å | Aromatic |
CAF | HAF | sing | 1.08Å | 1.08Å | |
CAI | CAG | sing | 1.53Å | 1.53Å | |
CAG | CAH | sing | 1.53Å | 1.53Å | |
CAG | HAG | sing | 1.09Å | 1.10Å | |
CAG | HAGA | sing | 1.09Å | 1.10Å | |
CAH | CAL | sing | 1.53Å | 1.54Å | |
CAH | HAH | sing | 1.09Å | 1.10Å | |
CAH | HAHA | sing | 1.09Å | 1.10Å | |
CAI | CAM | sing | 1.53Å | 1.54Å | |
CAI | HAI | sing | 1.09Å | 1.10Å | |
CAI | HAIA | sing | 1.09Å | 1.10Å | |
CAN | CAJ | sing | 1.53Å | 1.52Å | |
CAJ | CAR | sing | 1.51Å | 1.53Å | |
CAJ | HAJ | sing | 1.09Å | 1.10Å | |
CAJ | HAJA | sing | 1.09Å | 1.10Å | |
CAO | CAK | sing | 1.53Å | 1.57Å | |
CAK | CAT | sing | 1.51Å | 1.51Å | |
CAK | HAK | sing | 1.09Å | 1.10Å | |
CAK | HAKA | sing | 1.09Å | 1.10Å | |
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 | 1.09Å | 1.10Å | |
CAO | HAOA | sing | 1.09Å | 1.10Å | |
CAP | CAU | sing | 1.51Å | 1.55Å | |
CAP | HAP | sing | 1.09Å | 1.10Å | |
CAP | HAPA | sing | 1.09Å | 1.10Å | |
CAU | CAT | doub | 1.34Å | 1.38Å | |
CAU | CAW | sing | 1.47Å | 1.40Å | |
CAX | CAV | sing | 1.47Å | 1.42Å | |
CAW | CAX | doub | 1.41Å | 1.42Å | Aromatic |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
CAM | N11 | CAL | 117.6° | 111.2° |
CAM | N11 | CAN | 111.2° | 111.0° |
N11 | CAM | CAI | 114.2° | 109.5° |
N11 | CAM | HAM | 107.9° | 109.4° |
N11 | CAM | HAMA | 107.9° | 109.5° |
CAL | N11 | CAN | 102.5° | 111.0° |
N11 | CAL | CAH | 112.4° | 109.5° |
N11 | CAL | HAL | 108.5° | 109.5° |
N11 | CAL | HALA | 108.5° | 109.5° |
N11 | CAN | CAJ | 113.0° | 109.4° |
N11 | CAN | HAN | 108.3° | 109.5° |
N11 | CAN | HANA | 108.3° | 109.5° |
CAR | N12 | CAO | 119.8° | 121.6° |
CAR | N12 | CAP | 120.2° | 121.6° |
N12 | CAR | OAA | 119.6° | 120.0° |
N12 | CAR | CAJ | 121.1° | 120.0° |
CAO | N12 | CAP | 119.9° | 116.9° |
N12 | CAO | CAK | 109.2° | 107.6° |
N12 | CAO | HAO | 109.6° | 109.9° |
N12 | CAO | HAOA | 109.6° | 109.9° |
N12 | CAP | CAU | 109.2° | 110.0° |
N12 | CAP | HAP | 109.6° | 109.3° |
N12 | CAP | HAPA | 109.6° | 109.4° |
CAT | N13 | CAV | 123.4° | 123.4° |
CAT | N13 | HN13 | 118.3° | 118.3° |
N13 | CAT | CAK | 116.0° | 116.1° |
N13 | CAT | CAU | 120.2° | 121.2° |
CAV | N13 | HN13 | 118.3° | 118.3° |
N13 | CAV | OAB | 119.0° | 120.5° |
N13 | CAV | CAX | 118.3° | 119.0° |
OAA | CAR | CAJ | 119.4° | 120.0° |
OAB | CAV | CAX | 122.6° | 120.5° |
FAC | CAS | CAD | 123.8° | 119.7° |
FAC | CAS | CAF | 116.4° | 119.7° |
CAE | CAD | CAS | 119.1° | 120.9° |
CAE | CAD | HAD | 120.4° | 119.6° |
CAD | CAE | CAW | 122.3° | 119.6° |
CAD | CAE | HAE | 118.8° | 120.1° |
CAS | CAD | HAD | 120.5° | 119.5° |
CAD | CAS | CAF | 119.7° | 120.6° |
CAW | CAE | HAE | 118.8° | 120.2° |
CAE | CAW | CAU | 119.6° | 121.3° |
CAE | CAW | CAX | 117.6° | 119.7° |
CAX | CAF | CAS | 119.7° | 119.2° |
CAX | CAF | HAF | 120.1° | 120.4° |
CAF | CAX | CAV | 121.0° | 122.2° |
CAF | CAX | CAW | 121.2° | 119.9° |
CAS | CAF | HAF | 120.2° | 120.4° |
CAI | CAG | CAH | 109.8° | 109.2° |
CAI | CAG | HAG | 109.4° | 109.6° |
CAI | CAG | HAGA | 109.4° | 109.5° |
CAG | CAI | CAM | 110.0° | 109.3° |
CAG | CAI | HAI | 109.3° | 109.5° |
CAG | CAI | HAIA | 109.3° | 109.5° |
CAH | CAG | HAG | 109.3° | 109.5° |
CAH | CAG | HAGA | 109.4° | 109.6° |
CAG | CAH | CAL | 108.9° | 109.3° |
CAG | CAH | HAH | 109.7° | 109.5° |
CAG | CAH | HAHA | 109.7° | 109.5° |
HAG | CAG | HAGA | 109.6° | 109.5° |
CAL | CAH | HAH | 109.7° | 109.5° |
CAL | CAH | HAHA | 109.7° | 109.5° |
CAH | CAL | HAL | 108.5° | 109.4° |
CAH | CAL | HALA | 108.5° | 109.5° |
HAH | CAH | HAHA | 109.3° | 109.6° |
CAM | CAI | HAI | 109.3° | 109.5° |
CAM | CAI | HAIA | 109.3° | 109.6° |
CAI | CAM | HAM | 107.9° | 109.4° |
CAI | CAM | HAMA | 107.9° | 109.5° |
HAI | CAI | HAIA | 109.6° | 109.5° |
CAN | CAJ | CAR | 111.4° | 109.4° |
CAN | CAJ | HAJ | 108.8° | 109.5° |
CAN | CAJ | HAJA | 108.8° | 109.5° |
CAJ | CAN | HAN | 108.3° | 109.5° |
CAJ | CAN | HANA | 108.3° | 109.5° |
CAR | CAJ | HAJ | 108.8° | 109.4° |
CAR | CAJ | HAJA | 108.8° | 109.4° |
HAJ | CAJ | HAJA | 110.1° | 109.5° |
CAO | CAK | CAT | 109.8° | 111.1° |
CAO | CAK | HAK | 109.4° | 109.1° |
CAO | CAK | HAKA | 109.4° | 109.1° |
CAK | CAO | HAO | 109.6° | 109.8° |
CAK | CAO | HAOA | 109.6° | 109.9° |
CAT | CAK | HAK | 109.4° | 109.2° |
CAT | CAK | HAKA | 109.4° | 109.1° |
CAK | CAT | CAU | 123.8° | 122.7° |
HAK | CAK | HAKA | 109.6° | 109.2° |
HAL | CAL | HALA | 110.4° | 109.5° |
HAM | CAM | HAMA | 111.0° | 109.5° |
HAN | CAN | HANA | 110.6° | 109.5° |
HAO | CAO | HAOA | 109.3° | 109.8° |
CAU | CAP | HAP | 109.6° | 109.4° |
CAU | CAP | HAPA | 109.6° | 109.4° |
CAP | CAU | CAT | 122.2° | 123.1° |
CAP | CAU | CAW | 120.2° | 117.4° |
HAP | CAP | HAPA | 109.3° | 109.3° |
CAT | CAU | CAW | 117.5° | 119.5° |
CAU | CAW | CAX | 122.7° | 119.0° |
CAV | CAX | CAW | 117.7° | 117.9° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
CAM | N11 | CAL | CAN | 122.3° | 124.1° |
N11 | CAM | CAI | CAG | 46.8° | 59.1° |
CAM | N11 | CAL | CAH | 43.8° | 61.7° |
N11 | CAM | CAI | HAM | 120.0° | 119.9° |
N11 | CAM | CAI | HAMA | 120.0° | 120.1° |
N11 | CAM | CAI | HAI | 73.2° | 60.8° |
N11 | CAM | CAI | HAIA | 166.8° | 179.1° |
CAM | N11 | CAN | CAJ | 26.7° | 65.7° |
CAM | N11 | CAL | HAL | 163.8° | 178.3° |
CAM | N11 | CAL | HALA | 76.1° | 58.3° |
N11 | CAM | HAM | HAMA | 118.0° | 120.0° |
CAM | N11 | CAN | HAN | 93.3° | 54.2° |
CAM | N11 | CAN | HANA | 146.7° | 174.2° |
N11 | CAL | CAH | CAG | 54.4° | 59.2° |
N11 | CAL | CAH | HAL | 120.0° | 120.0° |
N11 | CAL | CAH | HALA | 120.0° | 120.0° |
N11 | CAL | CAH | HAH | 174.4° | 179.1° |
N11 | CAL | CAH | HAHA | 65.6° | 60.8° |
CAL | N11 | CAM | CAI | 40.2° | 61.7° |
CAL | N11 | CAN | CAJ | 153.3° | 170.0° |
N11 | CAL | HAL | HALA | 118.9° | 120.0° |
CAL | N11 | CAM | HAM | 79.8° | 58.3° |
CAL | N11 | CAM | HAMA | 160.2° | 178.2° |
CAL | N11 | CAN | HAN | 33.2° | 70.0° |
CAL | N11 | CAN | HANA | 86.7° | 50.0° |
CAN | N11 | CAL | CAH | 166.2° | 174.1° |
CAN | N11 | CAM | CAI | 157.9° | 174.2° |
N11 | CAN | CAJ | HAN | 120.0° | 120.0° |
N11 | CAN | CAJ | HANA | 120.0° | 120.0° |
N11 | CAN | CAJ | CAR | 129.2° | 180.0° |
N11 | CAN | CAJ | HAJ | 9.3° | 60.1° |
N11 | CAN | CAJ | HAJA | 110.8° | 60.0° |
CAN | N11 | CAL | HAL | 73.8° | 54.1° |
CAN | N11 | CAL | HALA | 46.2° | 65.9° |
CAN | N11 | CAM | HAM | 37.9° | 65.8° |
CAN | N11 | CAM | HAMA | 82.0° | 54.1° |
N11 | CAN | HAN | HANA | 118.5° | 120.0° |
CAR | N12 | CAO | CAP | 175.6° | 179.8° |
N12 | CAR | OAA | CAJ | 179.5° | 180.0° |
N12 | CAR | CAJ | CAN | 83.6° | 180.0° |
N12 | CAR | CAJ | HAJ | 156.4° | 60.0° |
N12 | CAR | CAJ | HAJA | 36.4° | 60.0° |
CAR | N12 | CAO | CAK | 114.0° | 116.5° |
CAR | N12 | CAO | HAO | 126.0° | 124.0° |
CAR | N12 | CAO | HAOA | 6.0° | 3.1° |
CAR | N12 | CAP | CAU | 134.0° | 136.6° |
CAR | N12 | CAP | HAP | 14.0° | 16.4° |
CAR | N12 | CAP | HAPA | 105.9° | 103.3° |
CAO | N12 | CAR | OAA | 2.9° | 180.0° |
CAO | N12 | CAR | CAJ | 177.6° | 0.0° |
N12 | CAO | CAK | HAO | 120.0° | 119.5° |
N12 | CAO | CAK | HAOA | 120.0° | 119.6° |
N12 | CAO | CAK | CAT | 45.7° | 47.7° |
N12 | CAO | CAK | HAK | 165.7° | 168.2° |
N12 | CAO | CAK | HAKA | 74.3° | 72.6° |
N12 | CAO | HAO | HAOA | 120.2° | 120.9° |
CAO | N12 | CAP | CAU | 41.6° | 43.2° |
CAO | N12 | CAP | HAP | 161.6° | 163.4° |
CAO | N12 | CAP | HAPA | 78.5° | 77.0° |
CAP | N12 | CAR | OAA | 178.5° | 0.3° |
CAP | N12 | CAR | CAJ | 2.0° | 179.7° |
CAP | N12 | CAO | CAK | 61.6° | 63.3° |
CAP | N12 | CAO | HAO | 58.4° | 56.2° |
CAP | N12 | CAO | HAOA | 178.3° | 177.2° |
N12 | CAP | CAU | HAP | 120.0° | 120.1° |
N12 | CAP | CAU | HAPA | 120.0° | 120.2° |
N12 | CAP | HAP | HAPA | 120.1° | 119.7° |
N12 | CAP | CAU | CAT | 10.0° | 10.4° |
N12 | CAP | CAU | CAW | 173.3° | 169.5° |
CAT | N13 | CAV | HN13 | 180.0° | 180.0° |
CAT | N13 | CAV | OAB | 179.5° | 179.9° |
N13 | CAT | CAK | CAO | 160.1° | 159.7° |
N13 | CAT | CAK | CAU | 179.5° | 180.0° |
N13 | CAT | CAK | HAK | 40.1° | 39.3° |
N13 | CAT | CAK | HAKA | 79.9° | 80.0° |
N13 | CAT | CAU | CAP | 178.3° | 179.3° |
N13 | CAT | CAU | CAW | 1.5° | 0.8° |
CAT | N13 | CAV | CAX | 0.3° | 0.1° |
N13 | CAV | OAB | CAX | 179.2° | 179.9° |
N13 | CAV | CAX | CAF | 179.7° | 179.8° |
CAV | N13 | CAT | CAK | 178.9° | 179.4° |
CAV | N13 | CAT | CAU | 0.6° | 0.6° |
N13 | CAV | CAX | CAW | 2.1° | 0.2° |
HN13 | N13 | CAV | OAB | 0.5° | 0.1° |
HN13 | N13 | CAT | CAK | 1.1° | 0.7° |
HN13 | N13 | CAT | CAU | 179.4° | 179.3° |
HN13 | N13 | CAV | CAX | 179.7° | 179.9° |
OAA | CAR | CAJ | CAN | 95.8° | 0.0° |
OAA | CAR | CAJ | HAJ | 24.2° | 120.0° |
OAA | CAR | CAJ | HAJA | 144.2° | 120.0° |
OAB | CAV | CAX | CAF | 0.5° | 0.2° |
OAB | CAV | CAX | CAW | 177.1° | 179.7° |
FAC | CAS | CAD | CAE | 175.0° | 180.0° |
FAC | CAS | CAD | CAF | 179.0° | 180.0° |
FAC | CAS | CAD | HAD | 5.0° | 0.0° |
FAC | CAS | CAF | CAX | 177.7° | 180.0° |
FAC | CAS | CAF | HAF | 2.3° | 0.0° |
CAE | CAD | CAS | HAD | 180.0° | 180.0° |
CAD | CAE | CAW | HAE | 180.0° | 180.0° |
CAE | CAD | CAS | CAF | 4.0° | 0.0° |
CAD | CAE | CAW | CAU | 179.1° | 180.0° |
CAD | CAE | CAW | CAX | 4.5° | 0.1° |
CAS | CAD | CAE | CAW | 5.7° | 0.1° |
CAS | CAD | CAE | HAE | 174.3° | 180.0° |
CAD | CAS | CAF | CAX | 1.4° | 0.0° |
CAD | CAS | CAF | HAF | 178.6° | 180.0° |
HAD | CAD | CAE | CAW | 174.3° | 179.9° |
HAD | CAD | CAE | HAE | 5.7° | 0.0° |
HAD | CAD | CAS | CAF | 176.0° | 180.0° |
CAE | CAW | CAX | CAF | 1.7° | 0.1° |
CAE | CAW | CAU | CAP | 2.9° | 0.3° |
CAE | CAW | CAU | CAT | 179.7° | 179.7° |
CAE | CAW | CAU | CAX | 176.2° | 179.9° |
CAE | CAW | CAX | CAV | 179.3° | 179.9° |
HAE | CAE | CAW | CAU | 0.9° | 0.0° |
HAE | CAE | CAW | CAX | 175.5° | 179.9° |
CAX | CAF | CAS | HAF | 180.0° | 180.0° |
CAF | CAX | CAW | CAU | 178.0° | 180.0° |
CAF | CAX | CAV | CAW | 177.6° | 180.0° |
CAS | CAF | CAX | CAV | 177.7° | 179.9° |
CAS | CAF | CAX | CAW | 0.2° | 0.1° |
HAF | CAF | CAX | CAV | 2.3° | 0.1° |
HAF | CAF | CAX | CAW | 179.8° | 179.9° |
CAI | CAG | CAH | HAG | 120.0° | 120.0° |
CAI | CAG | CAH | HAGA | 120.0° | 120.0° |
CAI | CAG | HAG | HAGA | 119.9° | 120.1° |
CAI | CAG | CAH | CAL | 63.5° | 57.6° |
CAI | CAG | CAH | HAH | 176.4° | 177.6° |
CAI | CAG | CAH | HAHA | 56.5° | 62.3° |
CAG | CAI | CAM | HAI | 120.0° | 119.9° |
CAG | CAI | CAM | HAIA | 120.0° | 120.0° |
CAG | CAI | HAI | HAIA | 119.8° | 120.0° |
CAG | CAI | CAM | HAM | 73.2° | 60.8° |
CAG | CAI | CAM | HAMA | 166.8° | 179.2° |
CAH | CAG | HAG | HAGA | 119.8° | 120.1° |
CAG | CAH | CAL | HAH | 120.0° | 119.9° |
CAG | CAH | CAL | HAHA | 120.0° | 119.9° |
CAG | CAH | HAH | HAHA | 120.2° | 120.1° |
CAH | CAG | CAI | CAM | 59.5° | 57.6° |
CAH | CAG | CAI | HAI | 60.6° | 62.3° |
CAH | CAG | CAI | HAIA | 179.5° | 177.7° |
CAG | CAH | CAL | HAL | 174.4° | 179.2° |
CAG | CAH | CAL | HALA | 65.6° | 60.8° |
HAG | CAG | CAH | CAL | 56.5° | 177.6° |
HAG | CAG | CAH | HAH | 63.6° | 62.5° |
HAG | CAG | CAH | HAHA | 176.5° | 57.7° |
HAG | CAG | CAI | CAM | 60.5° | 177.6° |
HAG | CAG | CAI | HAI | 179.5° | 57.6° |
HAG | CAG | CAI | HAIA | 59.5° | 62.4° |
HAGA | CAG | CAH | CAL | 176.4° | 62.3° |
HAGA | CAG | CAH | HAH | 56.4° | 57.6° |
HAGA | CAG | CAH | HAHA | 63.6° | 177.8° |
HAGA | CAG | CAI | CAM | 179.5° | 62.4° |
HAGA | CAG | CAI | HAI | 59.5° | 177.7° |
HAGA | CAG | CAI | HAIA | 60.5° | 57.7° |
CAL | CAH | HAH | HAHA | 120.3° | 120.1° |
CAH | CAL | HAL | HALA | 118.8° | 120.0° |
HAH | CAH | CAL | HAL | 65.6° | 60.9° |
HAH | CAH | CAL | HALA | 54.4° | 59.1° |
HAHA | CAH | CAL | HAL | 54.4° | 59.2° |
HAHA | CAH | CAL | HALA | 174.4° | 179.2° |
CAM | CAI | HAI | HAIA | 119.8° | 120.2° |
CAI | CAM | HAM | HAMA | 118.1° | 120.0° |
HAI | CAI | CAM | HAM | 166.8° | 179.3° |
HAI | CAI | CAM | HAMA | 46.8° | 59.3° |
HAIA | CAI | CAM | HAM | 46.8° | 59.2° |
HAIA | CAI | CAM | HAMA | 73.2° | 60.8° |
CAN | CAJ | CAR | HAJ | 120.0° | 120.0° |
CAN | CAJ | CAR | HAJA | 120.0° | 120.0° |
CAN | CAJ | HAJ | HAJA | 119.2° | 120.1° |
CAJ | CAN | HAN | HANA | 118.5° | 120.0° |
CAR | CAJ | HAJ | HAJA | 119.2° | 120.0° |
CAR | CAJ | CAN | HAN | 110.7° | 60.0° |
CAR | CAJ | CAN | HANA | 9.2° | 60.0° |
HAJ | CAJ | CAN | HAN | 129.3° | 180.0° |
HAJ | CAJ | CAN | HANA | 110.8° | 60.0° |
HAJA | CAJ | CAN | HAN | 9.2° | 59.9° |
HAJA | CAJ | CAN | HANA | 129.2° | 180.0° |
CAO | CAK | CAT | HAK | 120.0° | 120.4° |
CAO | CAK | CAT | HAKA | 120.0° | 120.3° |
CAO | CAK | HAK | HAKA | 119.9° | 119.1° |
CAK | CAO | HAO | HAOA | 120.1° | 120.9° |
CAO | CAK | CAT | CAU | 20.4° | 20.3° |
CAT | CAK | HAK | HAKA | 119.9° | 119.2° |
CAT | CAK | CAO | HAO | 74.3° | 71.8° |
CAT | CAK | CAO | HAOA | 165.7° | 167.3° |
CAK | CAT | CAU | CAP | 2.2° | 0.7° |
CAK | CAT | CAU | CAW | 179.0° | 179.2° |
HAK | CAK | CAO | HAO | 45.7° | 48.6° |
HAK | CAK | CAO | HAOA | 74.3° | 72.3° |
HAK | CAK | CAT | CAU | 140.4° | 140.7° |
HAKA | CAK | CAO | HAO | 165.7° | 167.8° |
HAKA | CAK | CAO | HAOA | 45.7° | 46.9° |
HAKA | CAK | CAT | CAU | 99.6° | 100.0° |
CAU | CAP | HAP | HAPA | 120.1° | 119.7° |
CAP | CAU | CAT | CAW | 176.7° | 180.0° |
CAP | CAU | CAW | CAX | 179.1° | 179.6° |
HAP | CAP | CAU | CAT | 130.0° | 130.5° |
HAP | CAP | CAU | CAW | 53.3° | 49.4° |
HAPA | CAP | CAU | CAT | 110.0° | 109.7° |
HAPA | CAP | CAU | CAW | 66.6° | 70.3° |
CAT | CAU | CAW | CAX | 4.1° | 0.4° |
CAU | CAW | CAX | CAV | 4.4° | 0.0° |