F94
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
CAP | CAQ | doub | 1.37Å | 1.39Å | Aromatic |
CAP | CAO | sing | 1.39Å | 1.40Å | Aromatic |
CAQ | CAC | sing | 1.39Å | 1.40Å | Aromatic |
OAR | CAO | sing | 1.36Å | 1.36Å | |
CAO | CAN | doub | 1.38Å | 1.39Å | Aromatic |
OAG | CAD | doub | 1.22Å | 1.24Å | |
CAC | CAD | sing | 1.48Å | 1.40Å | |
CAC | CAB | doub | 1.41Å | 1.38Å | Aromatic |
CAD | CAE | sing | 1.42Å | 1.39Å | |
CAN | CAB | sing | 1.39Å | 1.40Å | Aromatic |
CAB | OAA | sing | 1.35Å | 1.34Å | |
CAE | CAF | doub | 1.36Å | 1.39Å | |
OAA | CAF | sing | 1.34Å | 1.35Å | |
CAF | CAH | sing | 1.48Å | 1.40Å | |
CAH | CAK | doub | 1.39Å | 1.39Å | Aromatic |
CAH | CAJ | sing | 1.40Å | 1.40Å | Aromatic |
CAK | CAL | sing | 1.39Å | 1.42Å | Aromatic |
CAJ | CAI | doub | 1.38Å | 1.40Å | Aromatic |
CAL | OAS | sing | 1.36Å | 1.36Å | |
CAL | CAM | doub | 1.39Å | 1.39Å | Aromatic |
CAI | CAM | sing | 1.38Å | 1.38Å | Aromatic |
CAK | H1 | sing | 1.08Å | 1.08Å | |
OAS | H2 | sing | 0.97Å | 0.95Å | |
CAM | H3 | sing | 1.08Å | 1.08Å | |
CAI | H4 | sing | 1.08Å | 1.08Å | |
CAJ | H5 | sing | 1.08Å | 1.08Å | |
CAN | H6 | sing | 1.08Å | 1.08Å | |
OAR | H7 | sing | 0.97Å | 0.95Å | |
CAP | H8 | sing | 1.08Å | 1.08Å | |
CAQ | H9 | sing | 1.08Å | 1.08Å | |
CAE | H10 | sing | 1.08Å | 1.08Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
CAQ | CAP | CAO | 120.6° | 120.3° |
CAP | CAQ | CAC | 121.0° | 119.8° |
CAQ | CAP | H8 | 119.7° | 119.8° |
CAP | CAQ | H9 | 119.5° | 120.1° |
CAP | CAO | OAR | 120.9° | 119.7° |
CAP | CAO | CAN | 118.9° | 120.6° |
CAO | CAP | H8 | 119.7° | 119.8° |
CAQ | CAC | CAD | 121.8° | 121.3° |
CAQ | CAC | CAB | 117.5° | 120.3° |
CAC | CAQ | H9 | 119.5° | 120.2° |
OAR | CAO | CAN | 120.2° | 119.7° |
CAO | OAR | H7 | 109.5° | 114.0° |
CAO | CAN | CAB | 119.4° | 119.8° |
CAO | CAN | H6 | 120.3° | 120.2° |
OAG | CAD | CAC | 122.8° | 121.3° |
OAG | CAD | CAE | 119.0° | 121.3° |
CAD | CAC | CAB | 120.6° | 118.4° |
CAC | CAD | CAE | 118.1° | 117.4° |
CAC | CAB | CAN | 122.5° | 119.2° |
CAC | CAB | OAA | 119.0° | 119.9° |
CAD | CAE | CAF | 120.1° | 119.5° |
CAD | CAE | H10 | 120.0° | 120.2° |
CAN | CAB | OAA | 118.5° | 120.9° |
CAB | CAN | H6 | 120.3° | 120.1° |
CAB | OAA | CAF | 122.3° | 122.3° |
CAE | CAF | OAA | 119.4° | 122.5° |
CAE | CAF | CAH | 126.5° | 118.7° |
CAF | CAE | H10 | 119.9° | 120.2° |
OAA | CAF | CAH | 114.0° | 118.7° |
CAF | CAH | CAK | 122.8° | 120.1° |
CAF | CAH | CAJ | 118.9° | 120.1° |
CAK | CAH | CAJ | 118.3° | 119.7° |
CAH | CAK | CAL | 120.0° | 119.8° |
CAH | CAK | H1 | 120.0° | 120.1° |
CAH | CAJ | CAI | 121.0° | 120.0° |
CAH | CAJ | H5 | 119.5° | 120.0° |
CAK | CAL | OAS | 120.4° | 120.0° |
CAK | CAL | CAM | 121.3° | 120.0° |
CAL | CAK | H1 | 120.0° | 120.1° |
CAJ | CAI | CAM | 121.4° | 120.2° |
CAJ | CAI | H4 | 119.3° | 120.0° |
CAI | CAJ | H5 | 119.5° | 120.0° |
OAS | CAL | CAM | 118.2° | 120.0° |
CAL | OAS | H2 | 109.5° | 114.0° |
CAL | CAM | CAI | 118.1° | 120.3° |
CAL | CAM | H3 | 121.0° | 119.8° |
CAI | CAM | H3 | 121.0° | 119.9° |
CAM | CAI | H4 | 119.3° | 119.9° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
CAQ | CAP | CAO | H8 | 180.0° | 179.9° |
CAP | CAQ | CAC | H9 | 180.0° | 179.9° |
CAQ | CAP | CAO | OAR | 178.9° | 180.0° |
CAQ | CAP | CAO | CAN | 0.7° | 0.1° |
CAP | CAQ | CAC | CAD | 179.0° | 180.0° |
CAP | CAQ | CAC | CAB | 2.0° | 0.0° |
CAO | CAP | CAQ | CAC | 0.2° | 0.1° |
CAP | CAO | OAR | CAN | 178.2° | 180.0° |
CAP | CAO | CAN | CAB | 0.1° | 0.0° |
CAP | CAO | CAN | H6 | 179.9° | 180.0° |
CAP | CAO | OAR | H7 | 180.0° | 90.0° |
CAO | CAP | CAQ | H9 | 179.8° | 180.0° |
CAQ | CAC | CAD | OAG | 4.4° | 0.0° |
CAQ | CAC | CAD | CAB | 177.0° | 180.0° |
CAQ | CAC | CAD | CAE | 173.4° | 179.7° |
CAQ | CAC | CAB | CAN | 2.9° | 0.0° |
CAQ | CAC | CAB | OAA | 177.9° | 180.0° |
CAC | CAQ | CAP | H8 | 179.7° | 180.0° |
OAR | CAO | CAN | CAB | 178.1° | 180.0° |
OAR | CAO | CAN | H6 | 1.9° | 0.0° |
OAR | CAO | CAP | H8 | 1.1° | 0.0° |
CAO | CAN | CAB | CAC | 1.9° | 0.0° |
CAO | CAN | CAB | H6 | 180.0° | 180.0° |
CAO | CAN | CAB | OAA | 178.9° | 180.0° |
CAN | CAO | OAR | H7 | 1.8° | 90.0° |
CAN | CAO | CAP | H8 | 179.3° | 180.0° |
OAG | CAD | CAC | CAE | 177.8° | 179.7° |
OAG | CAD | CAC | CAB | 178.7° | 180.0° |
OAG | CAD | CAE | CAF | 179.6° | 179.7° |
OAG | CAD | CAE | H10 | 0.4° | 0.3° |
CAD | CAC | CAB | CAN | 179.9° | 180.0° |
CAD | CAC | CAB | OAA | 0.9° | 0.0° |
CAC | CAD | CAE | CAF | 2.5° | 0.6° |
CAD | CAC | CAQ | H9 | 1.0° | 0.1° |
CAC | CAD | CAE | H10 | 177.5° | 180.0° |
CAB | CAC | CAD | CAE | 3.5° | 0.3° |
CAC | CAB | CAN | OAA | 179.2° | 180.0° |
CAC | CAB | OAA | CAF | 6.6° | 0.0° |
CAC | CAB | CAN | H6 | 178.1° | 180.0° |
CAB | CAC | CAQ | H9 | 178.0° | 179.9° |
CAD | CAE | CAF | H10 | 180.0° | 179.4° |
CAD | CAE | CAF | OAA | 2.9° | 0.6° |
CAD | CAE | CAF | CAH | 179.6° | 179.7° |
CAN | CAB | OAA | CAF | 174.2° | 180.0° |
CAB | OAA | CAF | CAE | 7.7° | 0.2° |
CAB | OAA | CAF | CAH | 175.3° | 180.0° |
OAA | CAB | CAN | H6 | 1.2° | 0.0° |
CAE | CAF | OAA | CAH | 177.1° | 179.7° |
CAE | CAF | CAH | CAK | 18.8° | 179.8° |
CAE | CAF | CAH | CAJ | 162.4° | 0.3° |
OAA | CAF | CAH | CAK | 164.3° | 0.0° |
OAA | CAF | CAH | CAJ | 14.5° | 179.5° |
OAA | CAF | CAE | H10 | 177.1° | 180.0° |
CAF | CAH | CAK | CAJ | 178.8° | 179.5° |
CAF | CAH | CAK | CAL | 178.7° | 180.0° |
CAF | CAH | CAJ | CAI | 179.0° | 179.9° |
CAF | CAH | CAK | H1 | 1.2° | 0.2° |
CAF | CAH | CAJ | H5 | 1.0° | 0.2° |
CAH | CAF | CAE | H10 | 0.4° | 0.3° |
CAH | CAK | CAL | H1 | 180.0° | 179.8° |
CAK | CAH | CAJ | CAI | 0.1° | 0.6° |
CAH | CAK | CAL | OAS | 178.7° | 179.8° |
CAH | CAK | CAL | CAM | 0.1° | 0.2° |
CAK | CAH | CAJ | H5 | 179.9° | 179.7° |
CAJ | CAH | CAK | CAL | 0.1° | 0.5° |
CAH | CAJ | CAI | H5 | 180.0° | 179.7° |
CAH | CAJ | CAI | CAM | 0.3° | 0.3° |
CAJ | CAH | CAK | H1 | 180.0° | 179.7° |
CAH | CAJ | CAI | H4 | 179.7° | 179.7° |
CAK | CAL | OAS | CAM | 178.8° | 180.0° |
CAK | CAL | CAM | CAI | 0.1° | 0.0° |
CAK | CAL | OAS | H2 | 180.0° | 90.0° |
CAK | CAL | CAM | H3 | 179.8° | 180.0° |
CAJ | CAI | CAM | CAL | 0.3° | 0.0° |
CAJ | CAI | CAM | H4 | 180.0° | 180.0° |
CAJ | CAI | CAM | H3 | 179.6° | 180.0° |
OAS | CAL | CAM | CAI | 179.0° | 180.0° |
OAS | CAL | CAK | H1 | 1.2° | 0.0° |
OAS | CAL | CAM | H3 | 1.0° | 0.0° |
CAL | CAM | CAI | H3 | 180.0° | 180.0° |
CAM | CAL | CAK | H1 | 180.0° | 180.0° |
CAM | CAL | OAS | H2 | 1.2° | 90.0° |
CAL | CAM | CAI | H4 | 179.7° | 180.0° |
CAM | CAI | CAJ | H5 | 179.6° | 180.0° |
H3 | CAM | CAI | H4 | 0.3° | 0.0° |
H4 | CAI | CAJ | H5 | 0.4° | 0.0° |
H8 | CAP | CAQ | H9 | 0.2° | 0.1° |