SV7
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
OAA | PAB | sing | 1.61Å | 1.51Å | |
PAB | OAC | sing | 1.61Å | 1.47Å | |
PAB | OAD | doub | 1.48Å | 1.41Å | |
PAB | CAE | sing | 1.81Å | 1.67Å | |
CAE | CAF | sing | 1.38Å | 1.39Å | Aromatic |
CAE | CAJ | doub | 1.38Å | 1.40Å | Aromatic |
CAF | CAG | doub | 1.38Å | 1.40Å | Aromatic |
CAG | CAH | sing | 1.38Å | 1.40Å | Aromatic |
CAH | CAI | doub | 1.38Å | 1.40Å | Aromatic |
CAI | CAJ | sing | 1.38Å | 1.41Å | Aromatic |
OAA | HAA | sing | 0.97Å | 0.95Å | |
OAC | HAC | sing | 0.97Å | 0.95Å | |
CAF | HAF | sing | 1.08Å | 1.08Å | |
CAJ | HAJ | sing | 1.08Å | 1.08Å | |
CAG | HAG | sing | 1.08Å | 1.08Å | |
CAH | HAH | sing | 1.08Å | 1.08Å | |
CAI | HAI | sing | 1.08Å | 1.08Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
OAA | PAB | OAC | 107.4° | 109.5° |
OAA | PAB | OAD | 98.4° | 109.5° |
OAA | PAB | CAE | 104.8° | 109.5° |
PAB | OAA | HAA | 109.5° | 114.0° |
OAC | PAB | OAD | 114.2° | 109.4° |
OAC | PAB | CAE | 114.2° | 109.5° |
PAB | OAC | HAC | 109.5° | 114.0° |
OAD | PAB | CAE | 115.8° | 109.5° |
PAB | CAE | CAF | 122.0° | 120.0° |
PAB | CAE | CAJ | 118.5° | 120.0° |
CAF | CAE | CAJ | 119.5° | 120.0° |
CAE | CAF | CAG | 119.7° | 120.0° |
CAE | CAF | HAF | 120.2° | 120.0° |
CAE | CAJ | CAI | 120.7° | 120.0° |
CAE | CAJ | HAJ | 119.6° | 120.1° |
CAF | CAG | CAH | 121.4° | 120.0° |
CAG | CAF | HAF | 120.1° | 120.0° |
CAF | CAG | HAG | 119.3° | 120.0° |
CAG | CAH | CAI | 118.6° | 120.0° |
CAH | CAG | HAG | 119.3° | 120.0° |
CAG | CAH | HAH | 120.7° | 120.0° |
CAH | CAI | CAJ | 120.0° | 120.0° |
CAI | CAH | HAH | 120.7° | 120.0° |
CAH | CAI | HAI | 120.0° | 120.0° |
CAI | CAJ | HAJ | 119.7° | 120.0° |
CAJ | CAI | HAI | 120.0° | 120.0° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
OAA | PAB | OAC | OAD | 107.9° | 120.0° |
OAA | PAB | OAC | CAE | 115.7° | 120.0° |
OAA | PAB | OAD | CAE | 110.9° | 120.0° |
OAA | PAB | CAE | CAF | 0.1° | 175.0° |
OAA | PAB | CAE | CAJ | 179.3° | 5.3° |
OAA | PAB | OAC | HAC | 107.9° | 60.0° |
OAC | PAB | OAD | CAE | 135.7° | 120.0° |
OAC | PAB | CAE | CAF | 117.1° | 55.0° |
OAC | PAB | CAE | CAJ | 62.1° | 125.3° |
OAC | PAB | OAA | HAA | 118.6° | 60.0° |
OAD | PAB | CAE | CAF | 107.2° | 65.0° |
OAD | PAB | CAE | CAJ | 73.6° | 114.8° |
OAD | PAB | OAA | HAA | 0.0° | 60.0° |
OAD | PAB | OAC | HAC | 0.0° | 180.0° |
PAB | CAE | CAF | CAJ | 179.1° | 179.8° |
PAB | CAE | CAF | CAG | 179.6° | 180.0° |
PAB | CAE | CAJ | CAI | 179.9° | 179.8° |
CAE | PAB | OAA | HAA | 119.6° | 180.0° |
CAE | PAB | OAC | HAC | 136.4° | 60.0° |
PAB | CAE | CAF | HAF | 0.4° | 0.0° |
PAB | CAE | CAJ | HAJ | 0.1° | 0.0° |
CAE | CAF | CAG | HAF | 180.0° | 180.0° |
CAE | CAF | CAG | CAH | 0.1° | 0.0° |
CAF | CAE | CAJ | CAI | 0.7° | 0.4° |
CAF | CAE | CAJ | HAJ | 179.3° | 179.7° |
CAE | CAF | CAG | HAG | 179.9° | 179.9° |
CAJ | CAE | CAF | CAG | 0.5° | 0.2° |
CAE | CAJ | CAI | CAH | 0.4° | 0.4° |
CAE | CAJ | CAI | HAJ | 180.0° | 179.9° |
CAJ | CAE | CAF | HAF | 179.5° | 179.7° |
CAE | CAJ | CAI | HAI | 179.6° | 179.7° |
CAF | CAG | CAH | HAG | 180.0° | 179.9° |
CAF | CAG | CAH | CAI | 0.4° | 0.0° |
CAF | CAG | CAH | HAH | 179.6° | 179.9° |
CAG | CAH | CAI | HAH | 180.0° | 179.9° |
CAG | CAH | CAI | CAJ | 0.2° | 0.1° |
CAH | CAG | CAF | HAF | 179.9° | 180.0° |
CAG | CAH | CAI | HAI | 179.8° | 179.9° |
CAH | CAI | CAJ | HAI | 180.0° | 179.9° |
CAH | CAI | CAJ | HAJ | 179.6° | 179.8° |
CAI | CAH | CAG | HAG | 179.6° | 180.0° |
CAJ | CAI | CAH | HAH | 179.8° | 179.9° |
HAF | CAF | CAG | HAG | 0.1° | 0.1° |
HAJ | CAJ | CAI | HAI | 0.4° | 0.2° |
HAG | CAG | CAH | HAH | 0.4° | 0.0° |
HAH | CAH | CAI | HAI | 0.2° | 0.0° |