OXL
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C1 | C2 | sing | 1.49Å | 1.53Å | |
C1 | O1 | doub | 1.28Å | 1.28Å | |
C1 | O3 | sing | 1.28Å | 1.29Å | |
C2 | O2 | doub | 1.28Å | 1.32Å | |
C2 | O4 | sing | 1.28Å | 1.33Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C2 | C1 | O1 | 115.5° | 120.0° |
C2 | C1 | O3 | 136.5° | 120.0° |
C1 | C2 | O2 | 137.9° | 120.0° |
C1 | C2 | O4 | 113.5° | 120.0° |
O1 | C1 | O3 | 107.8° | 120.0° |
O2 | C2 | O4 | 107.8° | 120.0° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C2 | C1 | O1 | O3 | 175.1° | 179.7° |
C1 | C2 | O2 | O4 | 168.7° | 180.0° |
O1 | C1 | C2 | O2 | 164.0° | 0.0° |
O1 | C1 | C2 | O4 | 4.2° | NaN° |
O3 | C1 | C2 | O2 | 22.8° | 179.7° |
O3 | C1 | C2 | O4 | 168.9° | 0.3° |