C3X
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | sing | 1.53Å | 1.55Å | |
| C1 | O1 | sing | 1.43Å | 1.44Å | |
| C1 | O5 | sing | 1.42Å | 1.42Å | |
| C1 | H1 | sing | 1.09Å | 1.11Å | |
| C2 | C3 | sing | 1.53Å | 1.53Å | |
| C2 | O2 | sing | 1.43Å | 1.42Å | |
| C2 | H2 | sing | 1.09Å | 1.12Å | |
| C3 | C4 | sing | 1.53Å | 1.54Å | |
| C3 | O3 | sing | 1.43Å | 1.41Å | |
| C3 | H3 | sing | 1.09Å | 1.11Å | |
| C4 | C5 | sing | 1.53Å | 1.54Å | |
| C4 | O4 | sing | 1.43Å | 1.41Å | |
| C4 | H4 | sing | 1.09Å | 1.12Å | |
| C5 | O5 | sing | 1.43Å | 1.43Å | |
| C5 | H51 | sing | 1.09Å | 1.11Å | |
| C5 | H52 | sing | 1.09Å | 1.11Å | |
| O1 | C1' | sing | 1.43Å | 1.44Å | |
| O2 | HO2 | sing | 0.97Å | 0.95Å | |
| O3 | HO3 | sing | 0.97Å | 0.95Å | |
| O4 | HO4 | sing | 0.97Å | 0.95Å | |
| C1' | C2' | sing | 1.53Å | 1.54Å | |
| C1' | H1'1 | sing | 1.09Å | 1.11Å | |
| C1' | H1'2 | sing | 1.09Å | 1.11Å | |
| C2' | C3' | sing | 1.53Å | 1.56Å | |
| C2' | O' | sing | 1.43Å | 1.44Å | |
| C2' | H2' | sing | 1.09Å | 1.12Å | |
| C3' | O' | sing | 1.43Å | 2.39Å | |
| C3' | H3'1 | sing | 1.09Å | 1.12Å | |
| C3' | H3'2 | sing | 1.09Å | 1.11Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | O1 | 110.8° | 109.4° |
| C2 | C1 | O5 | 110.9° | 109.9° |
| C2 | C1 | H1 | 106.8° | 109.4° |
| C1 | C2 | C3 | 110.3° | 109.1° |
| C1 | C2 | O2 | 110.3° | 109.6° |
| C1 | C2 | H2 | 107.8° | 109.5° |
| O1 | C1 | O5 | 106.7° | 109.4° |
| O1 | C1 | H1 | 110.9° | 109.3° |
| C1 | O1 | C1' | 114.9° | 106.8° |
| O5 | C1 | H1 | 110.8° | 109.4° |
| C1 | O5 | C5 | 116.4° | 107.6° |
| C3 | C2 | O2 | 107.9° | 109.7° |
| C3 | C2 | H2 | 110.3° | 109.5° |
| C2 | C3 | C4 | 111.3° | 108.7° |
| C2 | C3 | O3 | 110.0° | 109.6° |
| C2 | C3 | H3 | 107.6° | 109.6° |
| O2 | C2 | H2 | 110.3° | 109.5° |
| C2 | O2 | HO2 | 110.3° | 106.8° |
| C4 | C3 | O3 | 108.6° | 109.9° |
| C4 | C3 | H3 | 109.0° | 109.5° |
| C3 | C4 | C5 | 110.5° | 109.1° |
| C3 | C4 | O4 | 109.3° | 109.6° |
| C3 | C4 | H4 | 108.9° | 109.6° |
| O3 | C3 | H3 | 110.4° | 109.6° |
| C3 | O3 | HO3 | 110.0° | 106.9° |
| C5 | C4 | O4 | 109.3° | 109.6° |
| C5 | C4 | H4 | 108.8° | 109.6° |
| C4 | C5 | O5 | 109.4° | 109.8° |
| C4 | C5 | H51 | 112.2° | 109.4° |
| C4 | C5 | H52 | 112.3° | 109.4° |
| O4 | C4 | H4 | 110.1° | 109.5° |
| C4 | O4 | HO4 | 109.2° | 106.9° |
| O5 | C5 | H51 | 112.2° | 109.4° |
| O5 | C5 | H52 | 112.2° | 109.5° |
| H51 | C5 | H52 | 98.2° | 109.3° |
| O1 | C1' | C2' | 114.3° | 109.5° |
| O1 | C1' | H1'1 | 110.5° | 109.5° |
| O1 | C1' | H1'2 | 110.5° | 109.5° |
| C2' | C1' | H1'1 | 110.4° | 109.5° |
| C2' | C1' | H1'2 | 110.4° | 109.5° |
| C1' | C2' | C3' | 116.0° | 117.8° |
| C1' | C2' | O' | 106.6° | 117.8° |
| C1' | C2' | H2' | 106.0° | 115.7° |
| H1'1 | C1' | H1'2 | 99.8° | 109.4° |
| C3' | C2' | O' | 106.0° | 57.7° |
| C3' | C2' | H2' | 106.6° | 117.7° |
| C2' | C3' | O' | 35.3° | 57.6° |
| C2' | C3' | H3'1 | 151.2° | 117.9° |
| C2' | C3' | H3'2 | 151.2° | 117.7° |
| O' | C2' | H2' | 116.0° | 117.8° |
| C2' | O' | C3' | 38.7° | 64.7° |
| O' | C3' | H3'1 | 151.1° | 117.8° |
| O' | C3' | H3'2 | 151.1° | 117.8° |
| H3'1 | C3' | H3'2 | 46.4° | 115.7° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | O1 | O5 | 120.8° | 120.4° |
| C2 | C1 | O1 | H1 | 118.4° | 119.8° |
| C2 | C1 | O5 | H1 | 118.4° | 120.1° |
| C1 | C2 | C3 | O2 | 120.5° | 120.0° |
| C1 | C2 | C3 | H2 | 119.0° | 119.8° |
| C1 | C2 | O2 | H2 | 118.9° | 120.1° |
| C1 | C2 | C3 | C4 | 51.0° | 53.5° |
| C1 | C2 | C3 | O3 | 171.5° | 173.6° |
| C1 | C2 | C3 | H3 | 68.3° | 66.1° |
| C2 | C1 | O5 | C5 | 58.1° | 67.5° |
| C2 | C1 | O1 | C1' | 131.3° | 179.7° |
| C1 | C2 | O2 | HO2 | 180.0° | 59.9° |
| O1 | C1 | O5 | H1 | 120.8° | 119.8° |
| O1 | C1 | C2 | C3 | 170.0° | 178.7° |
| O1 | C1 | C2 | O2 | 70.9° | 58.6° |
| O1 | C1 | C2 | H2 | 49.5° | 61.5° |
| O1 | C1 | O5 | C5 | 178.9° | 172.3° |
| C1 | O1 | C1' | C2' | 167.5° | 179.9° |
| C1 | O1 | C1' | H1'1 | 67.3° | 60.1° |
| C1 | O1 | C1' | H1'2 | 42.2° | 59.9° |
| O5 | C1 | C2 | C3 | 51.7° | 61.1° |
| O5 | C1 | C2 | O2 | 170.8° | 178.8° |
| O5 | C1 | C2 | H2 | 68.8° | 58.6° |
| C1 | O5 | C5 | C4 | 59.4° | 67.5° |
| C1 | O5 | C5 | H51 | 65.9° | 52.6° |
| C1 | O5 | C5 | H52 | 175.3° | 172.4° |
| O5 | C1 | O1 | C1' | 107.9° | 59.9° |
| H1 | C1 | C2 | C3 | 69.1° | 58.9° |
| H1 | C1 | C2 | O2 | 49.9° | 61.1° |
| H1 | C1 | C2 | H2 | 170.4° | 178.7° |
| H1 | C1 | O5 | C5 | 60.3° | 52.6° |
| H1 | C1 | O1 | C1' | 12.9° | 59.9° |
| C3 | C2 | O2 | H2 | 120.5° | 120.2° |
| C2 | C3 | C4 | O3 | 121.3° | 119.9° |
| C2 | C3 | C4 | H3 | 118.5° | 119.7° |
| C2 | C3 | O3 | H3 | 118.5° | 120.3° |
| C2 | C3 | C4 | C5 | 53.1° | 53.6° |
| C2 | C3 | C4 | O4 | 173.5° | 173.5° |
| C2 | C3 | C4 | H4 | 66.3° | 66.4° |
| C3 | C2 | O2 | HO2 | 59.5° | 179.7° |
| C2 | C3 | O3 | HO3 | 180.0° | 180.0° |
| O2 | C2 | C3 | C4 | 171.6° | 173.6° |
| O2 | C2 | C3 | O3 | 68.0° | 66.4° |
| O2 | C2 | C3 | H3 | 52.3° | 53.9° |
| H2 | C2 | C3 | C4 | 68.0° | 66.2° |
| H2 | C2 | C3 | O3 | 52.5° | 53.8° |
| H2 | C2 | C3 | H3 | 172.7° | 174.1° |
| H2 | C2 | O2 | HO2 | 61.0° | 60.2° |
| C4 | C3 | O3 | H3 | 119.4° | 120.4° |
| C3 | C4 | C5 | O4 | 120.3° | 119.9° |
| C3 | C4 | C5 | H4 | 119.5° | 119.9° |
| C3 | C4 | O4 | H4 | 119.5° | 120.2° |
| C3 | C4 | C5 | O5 | 54.8° | 61.2° |
| C3 | C4 | C5 | H51 | 70.5° | 58.9° |
| C3 | C4 | C5 | H52 | 180.0° | 178.7° |
| C4 | C3 | O3 | HO3 | 57.9° | 60.7° |
| C3 | C4 | O4 | HO4 | 179.9° | 179.8° |
| O3 | C3 | C4 | C5 | 174.4° | 173.5° |
| O3 | C3 | C4 | O4 | 65.3° | 66.5° |
| O3 | C3 | C4 | H4 | 55.0° | 53.6° |
| H3 | C3 | C4 | C5 | 65.3° | 66.1° |
| H3 | C3 | C4 | O4 | 55.0° | 53.9° |
| H3 | C3 | C4 | H4 | 175.3° | 174.0° |
| H3 | C3 | O3 | HO3 | 61.5° | 59.7° |
| C5 | C4 | O4 | H4 | 119.4° | 120.2° |
| C4 | C5 | O5 | H51 | 125.3° | 120.1° |
| C4 | C5 | O5 | H52 | 125.3° | 120.1° |
| C4 | C5 | H51 | H52 | 118.2° | 119.8° |
| C5 | C4 | O4 | HO4 | 58.9° | 60.1° |
| O4 | C4 | C5 | O5 | 175.1° | 178.9° |
| O4 | C4 | C5 | H51 | 49.8° | 61.0° |
| O4 | C4 | C5 | H52 | 59.7° | 58.7° |
| H4 | C4 | C5 | O5 | 64.7° | 58.8° |
| H4 | C4 | C5 | H51 | 170.1° | 178.9° |
| H4 | C4 | C5 | H52 | 60.6° | 61.4° |
| H4 | C4 | O4 | HO4 | 60.6° | 60.1° |
| O5 | C5 | H51 | H52 | 118.1° | 119.9° |
| O1 | C1' | C2' | H1'1 | 125.3° | 120.0° |
| O1 | C1' | C2' | H1'2 | 125.3° | 120.1° |
| O1 | C1' | H1'1 | H1'2 | 116.3° | 120.0° |
| O1 | C1' | C2' | C3' | 46.2° | 178.7° |
| O1 | C1' | C2' | O' | 163.9° | 112.6° |
| O1 | C1' | C2' | H2' | 71.9° | 34.4° |
| C2' | C1' | H1'1 | H1'2 | 116.2° | 120.0° |
| C1' | C2' | C3' | O' | 118.1° | 106.9° |
| C1' | C2' | C3' | H2' | 117.7° | 146.2° |
| C1' | C2' | O' | H2' | 117.7° | 146.3° |
| C1' | C2' | C3' | H3'1 | 116.7° | 146.3° |
| C1' | C2' | C3' | H3'2 | 7.2° | 0.1° |
| H1'1 | C1' | C2' | C3' | 79.1° | 61.3° |
| H1'1 | C1' | C2' | O' | 38.7° | 127.4° |
| H1'1 | C1' | C2' | H2' | 162.8° | 85.6° |
| H1'2 | C1' | C2' | C3' | 171.5° | 58.6° |
| H1'2 | C1' | C2' | O' | 70.8° | 7.5° |
| H1'2 | C1' | C2' | H2' | 53.4° | 154.5° |
| C3' | C2' | O' | H2' | 118.1° | 106.8° |
| C2' | C3' | O' | H3'1 | 125.3° | 106.9° |
| C2' | C3' | O' | H3'2 | 125.3° | 106.8° |
| C2' | C3' | H3'1 | H3'2 | 141.1° | 147.0° |
| H2' | C2' | C3' | H3'1 | 1.0° | 0.1° |
| H2' | C2' | C3' | H3'2 | 110.6° | 146.3° |
| O' | C3' | H3'1 | H3'2 | 141.1° | 147.0° |
