RM4
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C2 | C1 | sing | 1.53Å | 1.53Å | |
C1 | O5 | sing | 1.43Å | 1.43Å | |
C1 | O1 | sing | 1.43Å | 1.41Å | |
C1 | H1 | sing | 1.09Å | 1.10Å | |
C3 | C2 | sing | 1.53Å | 1.54Å | |
C2 | O2 | sing | 1.43Å | 1.44Å | |
C2 | H2 | sing | 1.09Å | 1.10Å | |
O3 | C3 | sing | 1.43Å | 1.44Å | |
C3 | C4 | sing | 1.53Å | 1.54Å | |
C3 | H3 | sing | 1.09Å | 1.10Å | |
O4 | C4 | sing | 1.43Å | 1.45Å | |
C4 | C5 | sing | 1.53Å | 1.52Å | |
C4 | H4 | sing | 1.09Å | 1.10Å | |
C5 | C6 | sing | 1.53Å | 1.52Å | |
C5 | O5 | sing | 1.43Å | 1.43Å | |
C5 | H5 | sing | 1.09Å | 1.10Å | |
C6 | H61 | sing | 1.09Å | 1.10Å | |
C6 | H62 | sing | 1.09Å | 1.10Å | |
C6 | H63 | sing | 1.09Å | 1.10Å | |
O1 | HO1 | sing | 0.97Å | 0.95Å | |
O2 | HO2 | sing | 0.97Å | 0.95Å | |
O3 | HO3 | sing | 0.97Å | 0.95Å | |
O4 | HO4 | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C2 | C1 | O5 | 112.5° | 109.4° |
C2 | C1 | O1 | 108.1° | 109.5° |
C2 | C1 | H1 | 109.2° | 109.5° |
C1 | C2 | C3 | 107.4° | 109.1° |
C1 | C2 | O2 | 110.6° | 109.5° |
C1 | C2 | H2 | 112.8° | 109.5° |
O5 | C1 | O1 | 111.8° | 109.5° |
O5 | C1 | H1 | 105.3° | 109.5° |
C1 | O5 | C5 | 112.2° | 114.1° |
O1 | C1 | H1 | 109.9° | 109.5° |
C1 | O1 | HO1 | 109.5° | 114.0° |
C3 | C2 | O2 | 116.4° | 109.5° |
C3 | C2 | H2 | 106.5° | 109.6° |
C2 | C3 | O3 | 112.2° | 109.5° |
C2 | C3 | C4 | 112.7° | 109.1° |
C2 | C3 | H3 | 105.8° | 109.5° |
O2 | C2 | H2 | 103.1° | 109.5° |
C2 | O2 | HO2 | 109.5° | 114.0° |
O3 | C3 | C4 | 111.1° | 109.6° |
O3 | C3 | H3 | 107.6° | 109.6° |
C3 | O3 | HO3 | 109.5° | 114.0° |
C4 | C3 | H3 | 107.0° | 109.5° |
C3 | C4 | O4 | 111.9° | 109.6° |
C3 | C4 | C5 | 111.5° | 109.2° |
C3 | C4 | H4 | 106.4° | 109.5° |
O4 | C4 | C5 | 109.4° | 109.5° |
O4 | C4 | H4 | 108.6° | 109.5° |
C4 | O4 | HO4 | 109.5° | 114.0° |
C5 | C4 | H4 | 109.0° | 109.5° |
C4 | C5 | C6 | 109.2° | 109.5° |
C4 | C5 | O5 | 111.2° | 109.4° |
C4 | C5 | H5 | 107.9° | 109.5° |
C6 | C5 | O5 | 107.6° | 109.4° |
C6 | C5 | H5 | 111.5° | 109.5° |
C5 | C6 | H61 | 109.5° | 109.4° |
C5 | C6 | H62 | 109.5° | 109.5° |
C5 | C6 | H63 | 109.5° | 109.5° |
O5 | C5 | H5 | 109.5° | 109.5° |
H61 | C6 | H62 | 109.4° | 109.5° |
H61 | C6 | H63 | 109.5° | 109.4° |
H62 | C6 | H63 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C2 | C1 | O5 | O1 | 121.8° | 120.0° |
C2 | C1 | O5 | H1 | 118.8° | 120.0° |
C2 | C1 | O1 | H1 | 119.1° | 120.0° |
C1 | C2 | C3 | O2 | 124.6° | 119.9° |
C1 | C2 | C3 | H2 | 121.1° | 120.0° |
C1 | C2 | O2 | H2 | 120.9° | 120.1° |
C1 | C2 | C3 | O3 | 176.3° | 176.9° |
C1 | C2 | C3 | C4 | 50.0° | 56.9° |
C1 | C2 | C3 | H3 | 66.7° | 63.0° |
C2 | C1 | O5 | C5 | 63.7° | 61.2° |
C2 | C1 | O1 | HO1 | 89.9° | 180.0° |
C1 | C2 | O2 | HO2 | 1.4° | 60.0° |
O5 | C1 | O1 | H1 | 116.6° | 120.0° |
O5 | C1 | C2 | C3 | 57.1° | 57.6° |
O5 | C1 | C2 | O2 | 70.9° | 62.3° |
O5 | C1 | C2 | H2 | 174.2° | 177.6° |
C1 | O5 | C5 | C4 | 59.3° | 61.2° |
C1 | O5 | C5 | C6 | 178.9° | 178.8° |
C1 | O5 | C5 | H5 | 59.8° | 58.8° |
O5 | C1 | O1 | HO1 | 34.4° | 60.0° |
O1 | C1 | C2 | C3 | 179.0° | 177.6° |
O1 | C1 | C2 | O2 | 53.0° | 57.7° |
O1 | C1 | C2 | H2 | 61.9° | 62.4° |
O1 | C1 | O5 | C5 | 174.4° | 178.8° |
H1 | C1 | C2 | C3 | 59.4° | 62.4° |
H1 | C1 | C2 | O2 | 172.5° | 177.7° |
H1 | C1 | C2 | H2 | 57.6° | 57.6° |
H1 | C1 | O5 | C5 | 55.1° | 58.8° |
H1 | C1 | O1 | HO1 | 151.0° | 60.0° |
C3 | C2 | O2 | H2 | 116.2° | 120.2° |
C2 | C3 | O3 | C4 | 127.2° | 119.6° |
C2 | C3 | O3 | H3 | 116.0° | 120.2° |
C2 | C3 | C4 | H3 | 115.9° | 119.9° |
C2 | C3 | C4 | O4 | 171.6° | 176.9° |
C2 | C3 | C4 | C5 | 48.8° | 57.0° |
C2 | C3 | C4 | H4 | 69.9° | 62.9° |
C3 | C2 | O2 | HO2 | 121.5° | 179.6° |
C2 | C3 | O3 | HO3 | 38.2° | 59.9° |
O2 | C2 | C3 | O3 | 51.8° | 57.0° |
O2 | C2 | C3 | C4 | 74.6° | 62.9° |
O2 | C2 | C3 | H3 | 168.8° | 177.2° |
H2 | C2 | C3 | O3 | 62.5° | 63.2° |
H2 | C2 | C3 | C4 | 171.1° | 176.9° |
H2 | C2 | C3 | H3 | 54.5° | 57.0° |
H2 | C2 | O2 | HO2 | 122.3° | 60.1° |
O3 | C3 | C4 | H3 | 117.2° | 120.2° |
O3 | C3 | C4 | O4 | 61.4° | 63.2° |
O3 | C3 | C4 | C5 | 175.7° | 176.9° |
O3 | C3 | C4 | H4 | 57.0° | 57.0° |
C3 | C4 | O4 | C5 | 124.1° | 119.7° |
C3 | C4 | O4 | H4 | 117.1° | 120.1° |
C3 | C4 | C5 | H4 | 117.2° | 119.9° |
C3 | C4 | C5 | C6 | 170.2° | 177.5° |
C3 | C4 | C5 | O5 | 51.6° | 57.6° |
C3 | C4 | C5 | H5 | 68.5° | 62.4° |
C4 | C3 | O3 | HO3 | 89.0° | 179.6° |
C3 | C4 | O4 | HO4 | 36.6° | 180.0° |
H3 | C3 | C4 | O4 | 55.8° | 57.0° |
H3 | C3 | C4 | C5 | 67.1° | 62.9° |
H3 | C3 | C4 | H4 | 174.2° | 177.2° |
H3 | C3 | O3 | HO3 | 154.1° | 60.2° |
O4 | C4 | C5 | H4 | 118.6° | 120.2° |
O4 | C4 | C5 | C6 | 65.5° | 62.5° |
O4 | C4 | C5 | O5 | 175.9° | 177.6° |
O4 | C4 | C5 | H5 | 55.8° | 57.5° |
C4 | C5 | C6 | O5 | 120.8° | 119.9° |
C4 | C5 | C6 | H5 | 119.1° | 120.0° |
C4 | C5 | O5 | H5 | 119.1° | 120.0° |
C4 | C5 | C6 | H61 | 74.2° | 60.0° |
C4 | C5 | C6 | H62 | 165.8° | 180.0° |
C4 | C5 | C6 | H63 | 45.8° | 60.0° |
C5 | C4 | O4 | HO4 | 87.5° | 60.3° |
H4 | C4 | C5 | C6 | 53.1° | 57.7° |
H4 | C4 | C5 | O5 | 65.5° | 62.3° |
H4 | C4 | C5 | H5 | 174.4° | 177.7° |
H4 | C4 | O4 | HO4 | 153.7° | 59.8° |
C6 | C5 | O5 | H5 | 121.3° | 120.0° |
C5 | C6 | H61 | H62 | 120.0° | 120.0° |
C5 | C6 | H61 | H63 | 120.0° | 120.0° |
C5 | C6 | H62 | H63 | 120.0° | 120.0° |
O5 | C5 | C6 | H61 | 164.9° | 179.9° |
O5 | C5 | C6 | H62 | 45.0° | 60.1° |
O5 | C5 | C6 | H63 | 75.0° | 60.0° |
H5 | C5 | C6 | H61 | 44.9° | 60.0° |
H5 | C5 | C6 | H62 | 75.1° | 60.0° |
H5 | C5 | C6 | H63 | 164.9° | 180.0° |
H61 | C6 | H62 | H63 | 120.0° | 120.0° |