Q3O
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
O06 | C04 | doub | 1.22Å | 1.26Å | |
N07 | C08 | sing | 1.34Å | 1.49Å | |
N07 | C03 | sing | 1.37Å | 1.49Å | |
C04 | C03 | sing | 1.47Å | 1.53Å | |
C04 | O05 | sing | 1.35Å | 1.26Å | |
C08 | C09 | doub | 1.35Å | 1.53Å | |
C03 | C02 | doub | 1.37Å | 1.53Å | |
C09 | C10 | sing | 1.41Å | 1.49Å | |
C02 | C10 | sing | 1.47Å | 1.49Å | |
C02 | O01 | sing | 1.36Å | 1.40Å | |
C10 | O11 | doub | 1.22Å | 1.19Å | |
C08 | H081 | sing | 1.08Å | 1.08Å | |
C09 | H091 | sing | 1.08Å | 1.08Å | |
N07 | H071 | sing | 0.97Å | 1.00Å | |
O01 | H1 | sing | 0.97Å | 0.95Å | |
O05 | H2 | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O06 | C04 | C03 | 119.2° | 120.0° |
O06 | C04 | O05 | 119.8° | 119.9° |
C08 | N07 | C03 | 120.1° | 122.1° |
N07 | C08 | C09 | 120.2° | 121.7° |
N07 | C08 | H081 | 119.9° | 119.1° |
C08 | N07 | H071 | 119.9° | 119.0° |
N07 | C03 | C04 | 118.3° | 119.9° |
N07 | C03 | C02 | 119.9° | 120.2° |
C03 | N07 | H071 | 119.9° | 118.9° |
C03 | C04 | O05 | 121.0° | 120.0° |
C04 | C03 | C02 | 121.8° | 119.9° |
C04 | O05 | H2 | 109.5° | 117.0° |
C08 | C09 | C10 | 119.9° | 119.5° |
C09 | C08 | H081 | 119.9° | 119.1° |
C08 | C09 | H091 | 120.1° | 120.3° |
C03 | C02 | C10 | 119.8° | 118.3° |
C03 | C02 | O01 | 120.5° | 120.8° |
C09 | C10 | C02 | 120.1° | 118.1° |
C09 | C10 | O11 | 119.2° | 121.0° |
C10 | C09 | H091 | 120.0° | 120.2° |
C10 | C02 | O01 | 119.7° | 120.9° |
C02 | C10 | O11 | 120.7° | 121.0° |
C02 | O01 | H1 | 109.5° | 114.0° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O06 | C04 | C03 | N07 | 15.1° | 180.0° |
O06 | C04 | C03 | O05 | 179.6° | 179.9° |
O06 | C04 | C03 | C02 | 164.7° | 0.1° |
O06 | C04 | O05 | H2 | 0.0° | 0.0° |
C08 | N07 | C03 | H071 | 180.0° | 179.7° |
C08 | N07 | C03 | C04 | 179.9° | 180.0° |
N07 | C08 | C09 | H081 | 180.0° | 179.4° |
C08 | N07 | C03 | C02 | 0.1° | 0.0° |
N07 | C08 | C09 | C10 | 0.0° | 0.6° |
N07 | C08 | C09 | H091 | 180.0° | 179.4° |
N07 | C03 | C04 | C02 | 179.8° | 180.0° |
N07 | C03 | C04 | O05 | 164.5° | 0.0° |
C03 | N07 | C08 | C09 | 0.1° | 0.4° |
N07 | C03 | C02 | C10 | 0.1° | 0.0° |
N07 | C03 | C02 | O01 | 179.9° | 179.8° |
C03 | N07 | C08 | H081 | 179.9° | 179.7° |
C04 | C03 | C02 | C10 | 179.9° | 180.0° |
C04 | C03 | C02 | O01 | 0.1° | 0.3° |
C04 | C03 | N07 | H071 | 0.1° | 0.3° |
C03 | C04 | O05 | H2 | 179.6° | 179.9° |
O05 | C04 | C03 | C02 | 15.7° | 180.0° |
C08 | C09 | C10 | H091 | 180.0° | 180.0° |
C08 | C09 | C10 | C02 | 0.0° | 0.6° |
C08 | C09 | C10 | O11 | 180.0° | 179.4° |
C09 | C08 | N07 | H071 | 180.0° | 179.9° |
C03 | C02 | C10 | C09 | 0.1° | 0.3° |
C03 | C02 | C10 | O01 | 180.0° | 179.7° |
C03 | C02 | C10 | O11 | 180.0° | 179.7° |
C02 | C03 | N07 | H071 | 179.9° | 179.8° |
C03 | C02 | O01 | H1 | 180.0° | 179.7° |
C09 | C10 | C02 | O11 | 180.0° | 180.0° |
C09 | C10 | C02 | O01 | 180.0° | 180.0° |
C10 | C09 | C08 | H081 | 180.0° | 180.0° |
C02 | C10 | C09 | H091 | 180.0° | 179.4° |
C10 | C02 | O01 | H1 | 0.0° | 0.0° |
O01 | C02 | C10 | O11 | 0.0° | 0.0° |
O11 | C10 | C09 | H091 | 0.0° | 0.6° |
H081 | C08 | C09 | H091 | 0.0° | 0.0° |
H081 | C08 | N07 | H071 | 0.0° | 0.6° |