7FN
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
OAJ | CAG | doub | 1.22Å | 1.25Å | |
CAG | OAK | sing | 1.35Å | 1.25Å | |
CAG | CAD | sing | 1.47Å | 1.35Å | |
OAE | CAD | sing | 1.35Å | 1.30Å | Aromatic |
OAE | CAA | sing | 1.35Å | 1.29Å | Aromatic |
CAD | CAC | doub | 1.37Å | 1.34Å | Aromatic |
OAI | CAF | doub | 1.22Å | 1.24Å | |
CAA | CAF | sing | 1.47Å | 1.34Å | |
CAA | CAB | doub | 1.37Å | 1.34Å | Aromatic |
CAC | CAB | sing | 1.40Å | 1.34Å | Aromatic |
CAF | OAH | sing | 1.35Å | 1.24Å | |
OAH | H1 | sing | 0.97Å | 0.95Å | |
OAK | H2 | sing | 0.97Å | 0.95Å | |
CAC | H3 | sing | 1.08Å | 1.08Å | |
CAB | H4 | sing | 1.08Å | 1.08Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
OAJ | CAG | OAK | 118.8° | 119.9° |
OAJ | CAG | CAD | 118.8° | 120.0° |
OAK | CAG | CAD | 122.2° | 120.0° |
CAG | OAK | H2 | 109.5° | 117.1° |
CAG | CAD | OAE | 121.6° | 125.8° |
CAG | CAD | CAC | 130.0° | 125.8° |
CAD | OAE | CAA | 109.5° | 109.4° |
OAE | CAD | CAC | 108.5° | 108.4° |
OAE | CAA | CAF | 121.4° | 125.8° |
OAE | CAA | CAB | 108.3° | 108.4° |
CAD | CAC | CAB | 106.7° | 106.9° |
CAD | CAC | H3 | 126.7° | 126.5° |
OAI | CAF | CAA | 119.3° | 120.0° |
OAI | CAF | OAH | 118.0° | 119.9° |
CAF | CAA | CAB | 130.2° | 125.8° |
CAA | CAF | OAH | 122.7° | 120.0° |
CAA | CAB | CAC | 107.0° | 106.9° |
CAA | CAB | H4 | 126.5° | 126.5° |
CAB | CAC | H3 | 126.6° | 126.5° |
CAC | CAB | H4 | 126.5° | 126.5° |
CAF | OAH | H1 | 109.5° | 117.1° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
OAJ | CAG | OAK | CAD | 175.5° | 180.0° |
OAJ | CAG | CAD | OAE | 12.3° | 180.0° |
OAJ | CAG | CAD | CAC | 168.8° | 0.1° |
OAJ | CAG | OAK | H2 | 0.0° | 0.0° |
OAK | CAG | CAD | OAE | 163.3° | 0.0° |
OAK | CAG | CAD | CAC | 15.7° | 180.0° |
CAG | CAD | OAE | CAC | 179.2° | 180.0° |
CAG | CAD | OAE | CAA | 179.2° | 180.0° |
CAG | CAD | CAC | CAB | 178.8° | 179.7° |
CAD | CAG | OAK | H2 | 175.6° | 180.0° |
CAG | CAD | CAC | H3 | 1.2° | 0.1° |
CAD | OAE | CAA | CAF | 179.6° | 180.0° |
CAD | OAE | CAA | CAB | 0.3° | 0.2° |
OAE | CAD | CAC | CAB | 0.3° | 0.3° |
OAE | CAD | CAC | H3 | 179.7° | 180.0° |
CAA | OAE | CAD | CAC | 0.0° | 0.1° |
OAE | CAA | CAF | OAI | 11.0° | 179.7° |
OAE | CAA | CAF | CAB | 179.1° | 179.7° |
OAE | CAA | CAB | CAC | 0.5° | 0.4° |
OAE | CAA | CAF | OAH | 165.3° | 0.3° |
OAE | CAA | CAB | H4 | 179.4° | 179.8° |
CAD | CAC | CAB | CAA | 0.5° | 0.4° |
CAD | CAC | CAB | H3 | 180.0° | 179.7° |
CAD | CAC | CAB | H4 | 179.5° | 179.8° |
OAI | CAF | CAA | OAH | 176.3° | 180.0° |
OAI | CAF | CAA | CAB | 169.9° | 0.0° |
OAI | CAF | OAH | H1 | 0.0° | 0.1° |
CAF | CAA | CAB | CAC | 179.7° | 179.8° |
CAA | CAF | OAH | H1 | 176.3° | 179.9° |
CAF | CAA | CAB | H4 | 0.3° | 0.0° |
CAA | CAB | CAC | H4 | 180.0° | 179.8° |
CAB | CAA | CAF | OAH | 13.8° | 180.0° |
CAA | CAB | CAC | H3 | 179.5° | 179.9° |
H3 | CAC | CAB | H4 | 0.6° | 0.1° |