6OM
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C2 | C3 | sing | 1.51Å | 1.45Å | |
C2 | C1 | doub | 1.31Å | 1.45Å | |
C3 | O1 | sing | 1.43Å | 1.31Å | |
C4 | C1 | sing | 1.51Å | 1.41Å | |
C1 | C5 | sing | 1.51Å | 1.46Å | |
C5 | O2 | sing | 1.43Å | 1.31Å | |
C2 | H1 | sing | 1.08Å | 1.08Å | |
C3 | H2 | sing | 1.09Å | 1.10Å | |
C3 | H3 | sing | 1.09Å | 1.10Å | |
C4 | H4 | sing | 1.09Å | 1.10Å | |
C4 | H5 | sing | 1.09Å | 1.10Å | |
C4 | H6 | sing | 1.09Å | 1.10Å | |
O1 | H7 | sing | 0.97Å | 0.95Å | |
O2 | H8 | sing | 0.97Å | 0.95Å | |
C5 | H9 | sing | 1.09Å | 1.10Å | |
C5 | H10 | sing | 1.09Å | 1.10Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C3 | C2 | C1 | 115.2° | 120.0° |
C2 | C3 | O1 | 108.2° | 109.5° |
C3 | C2 | H1 | 122.4° | 120.0° |
C2 | C3 | H2 | 109.8° | 109.5° |
C2 | C3 | H3 | 109.8° | 109.4° |
C2 | C1 | C4 | 124.8° | 120.0° |
C2 | C1 | C5 | 117.7° | 120.0° |
C1 | C2 | H1 | 122.4° | 120.0° |
O1 | C3 | H2 | 109.8° | 109.5° |
O1 | C3 | H3 | 109.8° | 109.5° |
C3 | O1 | H7 | 109.5° | 114.0° |
C4 | C1 | C5 | 117.5° | 120.0° |
C1 | C4 | H4 | 109.5° | 109.5° |
C1 | C4 | H5 | 109.5° | 109.5° |
C1 | C4 | H6 | 109.5° | 109.5° |
C1 | C5 | O2 | 106.2° | 109.5° |
C1 | C5 | H9 | 110.3° | 109.5° |
C1 | C5 | H10 | 110.3° | 109.5° |
C5 | O2 | H8 | 109.5° | 114.0° |
O2 | C5 | H9 | 110.3° | 109.5° |
O2 | C5 | H10 | 110.3° | 109.4° |
H2 | C3 | H3 | 109.5° | 109.4° |
H4 | C4 | H5 | 109.5° | 109.5° |
H4 | C4 | H6 | 109.5° | 109.4° |
H5 | C4 | H6 | 109.4° | 109.5° |
H9 | C5 | H10 | 109.5° | 109.4° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C3 | C2 | C1 | H1 | 180.0° | 180.0° |
C2 | C3 | O1 | H2 | 119.8° | 120.0° |
C2 | C3 | O1 | H3 | 119.8° | 120.0° |
C3 | C2 | C1 | C4 | 179.4° | 172.7° |
C3 | C2 | C1 | C5 | 0.3° | 6.9° |
C2 | C3 | H2 | H3 | 120.6° | 119.9° |
C2 | C3 | O1 | H7 | 180.0° | 180.0° |
C1 | C2 | C3 | O1 | 1.4° | 136.0° |
C2 | C1 | C4 | C5 | 179.1° | 179.7° |
C2 | C1 | C5 | O2 | 177.3° | 126.1° |
C1 | C2 | C3 | H2 | 118.4° | 104.0° |
C1 | C2 | C3 | H3 | 121.2° | 15.9° |
C2 | C1 | C4 | H4 | 180.0° | 90.3° |
C2 | C1 | C4 | H5 | 60.0° | 29.7° |
C2 | C1 | C4 | H6 | 60.0° | 149.7° |
C2 | C1 | C5 | H9 | 57.9° | 113.8° |
C2 | C1 | C5 | H10 | 63.2° | 6.1° |
O1 | C3 | C2 | H1 | 178.6° | 44.0° |
O1 | C3 | H2 | H3 | 120.6° | 120.0° |
C4 | C1 | C5 | O2 | 3.5° | 54.2° |
C4 | C1 | C2 | H1 | 0.6° | 7.3° |
C1 | C4 | H4 | H5 | 120.0° | 120.0° |
C1 | C4 | H4 | H6 | 120.0° | 120.0° |
C1 | C4 | H5 | H6 | 120.0° | 120.1° |
C4 | C1 | C5 | H9 | 123.0° | 65.9° |
C4 | C1 | C5 | H10 | 116.0° | 174.2° |
C1 | C5 | O2 | H9 | 119.5° | 120.1° |
C1 | C5 | O2 | H10 | 119.5° | 120.0° |
C5 | C1 | C2 | H1 | 179.7° | 173.0° |
C5 | C1 | C4 | H4 | 0.9° | 90.0° |
C5 | C1 | C4 | H5 | 119.2° | 150.0° |
C5 | C1 | C4 | H6 | 120.9° | 29.9° |
C1 | C5 | O2 | H8 | 180.0° | 180.0° |
C1 | C5 | H9 | H10 | 121.5° | 120.0° |
O2 | C5 | H9 | H10 | 121.5° | 120.0° |
H1 | C2 | C3 | H2 | 61.6° | 76.0° |
H1 | C2 | C3 | H3 | 58.8° | 164.1° |
H2 | C3 | O1 | H7 | 60.2° | 59.9° |
H3 | C3 | O1 | H7 | 60.2° | 60.0° |
H4 | C4 | H5 | H6 | 120.0° | 119.9° |
H8 | O2 | C5 | H9 | 60.5° | 59.9° |
H8 | O2 | C5 | H10 | 60.5° | 60.0° |