8EW
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C01 | C02 | sing | 1.51Å | 1.51Å | |
O09 | C08 | doub | 1.22Å | 1.26Å | |
C02 | C07 | doub | 1.33Å | 1.52Å | |
C02 | C03 | sing | 1.51Å | 1.35Å | |
O05 | C04 | doub | 1.21Å | 1.26Å | |
C07 | C08 | sing | 1.47Å | 1.52Å | |
C03 | C04 | sing | 1.51Å | 1.51Å | |
C08 | O10 | sing | 1.35Å | 1.26Å | |
C04 | O06 | sing | 1.34Å | 1.26Å | |
C01 | H1 | sing | 1.09Å | 1.10Å | |
C01 | H2 | sing | 1.09Å | 1.10Å | |
C01 | H3 | sing | 1.09Å | 1.10Å | |
C03 | H5 | sing | 1.09Å | 1.10Å | |
C03 | H6 | sing | 1.09Å | 1.10Å | |
O06 | H7 | sing | 0.97Å | 0.95Å | |
C07 | H8 | sing | 1.08Å | 1.08Å | |
O10 | H10 | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C01 | C02 | C07 | 118.0° | 120.0° |
C01 | C02 | C03 | 118.7° | 120.0° |
C02 | C01 | H1 | 109.5° | 109.5° |
C02 | C01 | H2 | 109.5° | 109.5° |
C02 | C01 | H3 | 109.5° | 109.5° |
O09 | C08 | C07 | 119.8° | 120.0° |
O09 | C08 | O10 | 120.1° | 120.0° |
C07 | C02 | C03 | 119.5° | 120.0° |
C02 | C07 | C08 | 112.4° | 120.0° |
C02 | C07 | H8 | 123.8° | 120.0° |
C02 | C03 | C04 | 119.7° | 109.5° |
C02 | C03 | H5 | 106.8° | 109.5° |
C02 | C03 | H6 | 106.9° | 109.5° |
O05 | C04 | C03 | 119.8° | 120.0° |
O05 | C04 | O06 | 119.6° | 120.0° |
C07 | C08 | O10 | 120.1° | 120.0° |
C08 | C07 | H8 | 123.8° | 120.0° |
C03 | C04 | O06 | 120.6° | 120.0° |
C04 | C03 | H5 | 106.9° | 109.4° |
C04 | C03 | H6 | 106.9° | 109.5° |
C08 | O10 | H10 | 109.5° | 117.0° |
C04 | O06 | H7 | 109.5° | 117.0° |
H1 | C01 | H2 | 109.5° | 109.5° |
H1 | C01 | H3 | 109.5° | 109.4° |
H2 | C01 | H3 | 109.5° | 109.4° |
H5 | C03 | H6 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C01 | C02 | C07 | C03 | 158.0° | 180.0° |
C01 | C02 | C07 | C08 | 74.5° | 7.5° |
C01 | C02 | C03 | C04 | 68.4° | 85.0° |
C02 | C01 | H1 | H2 | 120.0° | 120.1° |
C02 | C01 | H1 | H3 | 120.0° | 120.0° |
C02 | C01 | H2 | H3 | 120.0° | 120.0° |
C01 | C02 | C03 | H5 | 53.0° | 35.0° |
C01 | C02 | C03 | H6 | 170.1° | 155.0° |
C01 | C02 | C07 | H8 | 105.5° | 172.5° |
O09 | C08 | C07 | C02 | 32.6° | 6.5° |
O09 | C08 | C07 | O10 | 179.9° | 179.9° |
O09 | C08 | C07 | H8 | 147.4° | 173.5° |
O09 | C08 | O10 | H10 | 0.0° | 0.1° |
C02 | C07 | C08 | H8 | 180.0° | 180.0° |
C07 | C02 | C03 | C04 | 89.3° | 95.0° |
C02 | C07 | C08 | O10 | 147.4° | 173.6° |
C07 | C02 | C01 | H1 | 180.0° | 83.7° |
C07 | C02 | C01 | H2 | 60.0° | 156.3° |
C07 | C02 | C01 | H3 | 60.0° | 36.3° |
C07 | C02 | C03 | H5 | 149.2° | 145.0° |
C07 | C02 | C03 | H6 | 32.1° | 25.0° |
C02 | C03 | C04 | O05 | 24.7° | 0.1° |
C03 | C02 | C07 | C08 | 83.5° | 172.5° |
C02 | C03 | C04 | H5 | 121.4° | 120.0° |
C02 | C03 | C04 | H6 | 121.5° | 120.0° |
C02 | C03 | C04 | O06 | 155.3° | 180.0° |
C03 | C02 | C01 | H1 | 21.9° | 96.4° |
C03 | C02 | C01 | H2 | 98.2° | 23.7° |
C03 | C02 | C01 | H3 | 141.9° | 143.7° |
C02 | C03 | H5 | H6 | 115.3° | 120.0° |
C03 | C02 | C07 | H8 | 96.5° | 7.5° |
O05 | C04 | C03 | O06 | 179.9° | 179.9° |
O05 | C04 | C03 | H5 | 146.2° | 120.0° |
O05 | C04 | C03 | H6 | 96.7° | 120.0° |
O05 | C04 | O06 | H7 | 0.0° | 0.1° |
C07 | C08 | O10 | H10 | 179.9° | 180.0° |
C04 | C03 | H5 | H6 | 115.4° | 120.0° |
C03 | C04 | O06 | H7 | 179.9° | 180.0° |
O10 | C08 | C07 | H8 | 32.6° | 6.3° |
O06 | C04 | C03 | H5 | 33.9° | 60.0° |
O06 | C04 | C03 | H6 | 83.2° | 60.0° |
H1 | C01 | H2 | H3 | 120.0° | 119.9° |