J1Z
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
CAA | CAC | doub | 1.32Å | 1.34Å | Aromatic |
CAA | SAE | sing | 1.75Å | 1.69Å | Aromatic |
CAB | CAD | doub | 1.32Å | 1.34Å | Aromatic |
CAB | SAF | sing | 1.75Å | 1.69Å | Aromatic |
CAC | CAG | sing | 1.41Å | 1.35Å | Aromatic |
CAD | CAH | sing | 1.41Å | 1.35Å | Aromatic |
SAE | CAH | sing | 1.77Å | 1.68Å | Aromatic |
SAF | CAG | sing | 1.77Å | 1.68Å | Aromatic |
CAG | CAH | doub | 1.37Å | 1.41Å | Aromatic |
CAA | HAA | sing | 1.08Å | 1.08Å | |
CAB | HAB | sing | 1.08Å | 1.08Å | |
CAC | HAC | sing | 1.08Å | 1.08Å | |
CAD | HAD | sing | 1.08Å | 1.08Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
CAC | CAA | SAE | 106.3° | 110.4° |
CAA | CAC | CAG | 116.4° | 115.8° |
CAC | CAA | HAA | 126.8° | 124.8° |
CAA | CAC | HAC | 121.8° | 122.2° |
CAA | SAE | CAH | 98.1° | 91.4° |
SAE | CAA | HAA | 126.8° | 124.8° |
CAD | CAB | SAF | 106.4° | 110.4° |
CAB | CAD | CAH | 116.3° | 115.8° |
CAD | CAB | HAB | 126.7° | 124.8° |
CAB | CAD | HAD | 121.8° | 122.2° |
CAB | SAF | CAG | 98.0° | 91.4° |
SAF | CAB | HAB | 126.8° | 124.8° |
CAC | CAG | SAF | 140.9° | 137.6° |
CAC | CAG | CAH | 114.8° | 113.1° |
CAG | CAC | HAC | 121.8° | 122.1° |
CAD | CAH | SAE | 140.7° | 137.6° |
CAD | CAH | CAG | 114.9° | 113.1° |
CAH | CAD | HAD | 121.8° | 122.1° |
SAE | CAH | CAG | 104.5° | 109.3° |
SAF | CAG | CAH | 104.4° | 109.3° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
CAC | CAA | SAE | HAA | 180.0° | 179.8° |
CAA | CAC | CAG | HAC | 180.0° | 179.9° |
CAC | CAA | SAE | CAH | 0.2° | 0.0° |
CAA | CAC | CAG | SAF | 179.5° | 180.0° |
CAA | CAC | CAG | CAH | 0.1° | 0.1° |
SAE | CAA | CAC | CAG | 0.2° | 0.1° |
CAA | SAE | CAH | CAD | 179.7° | 180.0° |
CAA | SAE | CAH | CAG | 0.1° | 0.0° |
SAE | CAA | CAC | HAC | 179.8° | 180.0° |
CAD | CAB | SAF | HAB | 180.0° | 179.9° |
CAB | CAD | CAH | HAD | 180.0° | 180.0° |
CAB | CAD | CAH | SAE | 179.7° | 180.0° |
CAD | CAB | SAF | CAG | 0.4° | 0.1° |
CAB | CAD | CAH | CAG | 0.1° | 0.0° |
CAB | SAF | CAG | CAC | 179.7° | 179.9° |
SAF | CAB | CAD | CAH | 0.4° | 0.1° |
CAB | SAF | CAG | CAH | 0.3° | 0.0° |
SAF | CAB | CAD | HAD | 179.6° | 180.0° |
CAC | CAG | CAH | CAD | 179.7° | 180.0° |
CAC | CAG | CAH | SAE | 0.0° | 0.0° |
CAC | CAG | SAF | CAH | 179.4° | 179.9° |
CAG | CAC | CAA | HAA | 179.8° | 179.7° |
CAD | CAH | SAE | CAG | 179.6° | 180.0° |
CAD | CAH | CAG | SAF | 0.2° | 0.0° |
CAH | CAD | CAB | HAB | 179.6° | 179.9° |
SAE | CAH | CAG | SAF | 179.5° | 180.0° |
CAH | SAE | CAA | HAA | 179.8° | 179.7° |
SAE | CAH | CAD | HAD | 0.3° | 0.0° |
CAG | SAF | CAB | HAB | 179.6° | 179.9° |
SAF | CAG | CAC | HAC | 0.5° | 0.1° |
CAH | CAG | CAC | HAC | 179.9° | 180.0° |
CAG | CAH | CAD | HAD | 179.8° | 180.0° |
HAA | CAA | CAC | HAC | 0.2° | 0.2° |
HAB | CAB | CAD | HAD | 0.4° | 0.1° |