G3H
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
O1 | C1 | doub | 1.21Å | 1.44Å | |
C1 | C2 | sing | 1.51Å | 1.56Å | |
C1 | H11 | sing | 1.08Å | 1.08Å | |
C2 | O2 | sing | 1.43Å | 1.44Å | |
C2 | C3 | sing | 1.53Å | 1.56Å | |
C2 | H2 | sing | 1.09Å | 1.10Å | |
O2 | HO2 | sing | 0.97Å | 0.95Å | |
C3 | O1P | sing | 1.43Å | 1.46Å | |
C3 | H31 | sing | 1.09Å | 1.10Å | |
C3 | H32 | sing | 1.09Å | 1.10Å | |
O1P | P | sing | 1.61Å | 1.63Å | |
O2P | P | doub | 1.48Å | 1.55Å | |
O3P | P | sing | 1.61Å | 1.53Å | |
O3P | HOP3 | sing | 0.97Å | 0.95Å | |
O4P | P | sing | 1.61Å | 1.53Å | |
O4P | HOP4 | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O1 | C1 | C2 | 110.5° | 120.0° |
O1 | C1 | H11 | 124.8° | 120.0° |
C2 | C1 | H11 | 124.7° | 120.0° |
C1 | C2 | O2 | 109.9° | 109.5° |
C1 | C2 | C3 | 113.8° | 109.5° |
C1 | C2 | H2 | 105.5° | 109.5° |
O2 | C2 | C3 | 107.2° | 109.5° |
O2 | C2 | H2 | 112.3° | 109.5° |
C2 | O2 | HO2 | 109.5° | 114.0° |
C3 | C2 | H2 | 108.3° | 109.5° |
C2 | C3 | O1P | 116.9° | 109.5° |
C2 | C3 | H31 | 107.1° | 109.5° |
C2 | C3 | H32 | 107.1° | 109.5° |
O1P | C3 | H31 | 107.0° | 109.5° |
O1P | C3 | H32 | 107.1° | 109.4° |
C3 | O1P | P | 125.8° | 123.0° |
H31 | C3 | H32 | 111.8° | 109.5° |
O1P | P | O2P | 110.2° | 109.4° |
O1P | P | O3P | 110.0° | 109.5° |
O1P | P | O4P | 112.9° | 109.5° |
O2P | P | O3P | 109.3° | 109.5° |
O2P | P | O4P | 107.2° | 109.5° |
P | O3P | HOP3 | 109.5° | 114.0° |
O3P | P | O4P | 107.1° | 109.5° |
P | O4P | HOP4 | 109.5° | 114.0° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O1 | C1 | C2 | H11 | 180.0° | 179.7° |
O1 | C1 | C2 | O2 | 142.1° | 0.0° |
O1 | C1 | C2 | C3 | 97.7° | 120.0° |
O1 | C1 | C2 | H2 | 20.8° | 120.0° |
C1 | C2 | O2 | C3 | 124.1° | 120.0° |
C1 | C2 | O2 | H2 | 117.1° | 120.0° |
C1 | C2 | C3 | H2 | 116.9° | 120.0° |
C1 | C2 | O2 | HO2 | 180.0° | 60.0° |
C1 | C2 | C3 | O1P | 74.4° | 175.0° |
C1 | C2 | C3 | H31 | 45.6° | 55.0° |
C1 | C2 | C3 | H32 | 165.6° | 65.0° |
H11 | C1 | C2 | O2 | 37.9° | 179.7° |
H11 | C1 | C2 | C3 | 82.3° | 60.3° |
H11 | C1 | C2 | H2 | 159.1° | 59.7° |
O2 | C2 | C3 | H2 | 121.4° | 120.0° |
O2 | C2 | C3 | O1P | 164.0° | 65.0° |
O2 | C2 | C3 | H31 | 76.1° | 175.0° |
O2 | C2 | C3 | H32 | 44.0° | 55.0° |
C3 | C2 | O2 | HO2 | 55.9° | 59.9° |
C2 | C3 | O1P | H31 | 120.0° | 120.0° |
C2 | C3 | O1P | H32 | 120.0° | 120.1° |
C2 | C3 | H31 | H32 | 117.0° | 120.1° |
C2 | C3 | O1P | P | 136.7° | 180.0° |
H2 | C2 | O2 | HO2 | 62.9° | 179.9° |
H2 | C2 | C3 | O1P | 42.6° | 55.0° |
H2 | C2 | C3 | H31 | 162.5° | 65.0° |
H2 | C2 | C3 | H32 | 77.5° | 175.0° |
O1P | C3 | H31 | H32 | 117.0° | 119.9° |
C3 | O1P | P | O2P | 170.7° | 55.0° |
C3 | O1P | P | O3P | 68.7° | 175.0° |
C3 | O1P | P | O4P | 50.9° | 65.0° |
H31 | C3 | O1P | P | 16.7° | 60.0° |
H32 | C3 | O1P | P | 103.3° | 60.0° |
O1P | P | O2P | O3P | 121.0° | 120.0° |
O1P | P | O2P | O4P | 123.2° | 120.0° |
O1P | P | O3P | O4P | 123.1° | 120.0° |
O1P | P | O3P | HOP3 | 121.1° | 180.0° |
O1P | P | O4P | HOP4 | 121.5° | 60.1° |
O2P | P | O3P | O4P | 115.8° | 120.0° |
O2P | P | O3P | HOP3 | 0.0° | 60.0° |
O2P | P | O4P | HOP4 | 0.0° | 180.0° |
O3P | P | O4P | HOP4 | 117.2° | 59.9° |
HOP3 | O3P | P | O4P | 115.8° | 60.0° |