R10
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
O9 | P1 | doub | 1.48Å | 1.49Å | |
P1 | O7 | sing | 1.61Å | 1.50Å | |
P1 | O8 | sing | 1.61Å | 1.50Å | |
P1 | O6 | sing | 1.61Å | 1.61Å | |
O6 | C1 | sing | 1.43Å | 1.44Å | |
C1 | C2 | sing | 1.53Å | 1.52Å | |
C2 | O5 | sing | 1.43Å | 1.43Å | |
C2 | C3 | sing | 1.53Å | 1.55Å | |
C3 | O4 | sing | 1.43Å | 1.44Å | |
C3 | C4 | sing | 1.53Å | 1.55Å | |
C4 | O3 | sing | 1.43Å | 1.43Å | |
C4 | C5 | sing | 1.51Å | 1.51Å | |
C5 | O1 | doub | 1.21Å | 1.24Å | |
C5 | O2 | sing | 1.34Å | 1.52Å | |
O7 | H7 | sing | 0.97Å | 0.95Å | |
O8 | H8 | sing | 0.97Å | 0.95Å | |
C1 | H1C1 | sing | 1.09Å | 1.10Å | |
C1 | H1C2 | sing | 1.09Å | 1.10Å | |
C2 | H2 | sing | 1.09Å | 1.10Å | |
O5 | H5 | sing | 0.97Å | 0.95Å | |
C3 | H3 | sing | 1.09Å | 1.10Å | |
O4 | H4 | sing | 0.97Å | 0.95Å | |
C4 | HA | sing | 1.09Å | 1.10Å | |
O3 | HB | sing | 0.97Å | 0.95Å | |
O2 | HC | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O9 | P1 | O7 | 115.7° | 109.5° |
O9 | P1 | O8 | 108.5° | 109.5° |
O9 | P1 | O6 | 105.3° | 109.4° |
O7 | P1 | O8 | 115.6° | 109.5° |
O7 | P1 | O6 | 99.8° | 109.4° |
P1 | O7 | H7 | 109.5° | 114.0° |
O8 | P1 | O6 | 111.2° | 109.5° |
P1 | O8 | H8 | 109.5° | 114.0° |
P1 | O6 | C1 | 122.0° | 123.0° |
O6 | C1 | C2 | 112.2° | 109.5° |
O6 | C1 | H1C1 | 108.6° | 109.5° |
O6 | C1 | H1C2 | 108.0° | 109.5° |
C1 | C2 | O5 | 110.1° | 109.5° |
C1 | C2 | C3 | 112.4° | 109.5° |
C2 | C1 | H1C1 | 108.5° | 109.5° |
C2 | C1 | H1C2 | 107.9° | 109.5° |
C1 | C2 | H2 | 107.7° | 109.5° |
O5 | C2 | C3 | 111.5° | 109.5° |
O5 | C2 | H2 | 108.7° | 109.5° |
C2 | O5 | H5 | 109.5° | 114.0° |
C2 | C3 | O4 | 105.7° | 109.5° |
C2 | C3 | C4 | 110.0° | 109.5° |
C3 | C2 | H2 | 106.3° | 109.4° |
C2 | C3 | H3 | 113.3° | 109.5° |
O4 | C3 | C4 | 114.1° | 109.5° |
O4 | C3 | H3 | 109.2° | 109.4° |
C3 | O4 | H4 | 109.5° | 114.0° |
C3 | C4 | O3 | 111.2° | 109.5° |
C3 | C4 | C5 | 113.4° | 109.5° |
C4 | C3 | H3 | 104.8° | 109.5° |
C3 | C4 | HA | 105.9° | 109.5° |
O3 | C4 | C5 | 110.7° | 109.5° |
O3 | C4 | HA | 108.9° | 109.4° |
C4 | O3 | HB | 109.5° | 114.0° |
C4 | C5 | O1 | 125.8° | 120.0° |
C4 | C5 | O2 | 117.8° | 120.0° |
C5 | C4 | HA | 106.4° | 109.4° |
O1 | C5 | O2 | 111.8° | 119.9° |
C5 | O2 | HC | 109.5° | 117.0° |
H1C1 | C1 | H1C2 | 111.6° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O9 | P1 | O7 | O8 | 128.3° | 120.0° |
O9 | P1 | O7 | O6 | 112.3° | 119.9° |
O9 | P1 | O8 | O6 | 115.4° | 120.0° |
O9 | P1 | O6 | C1 | 60.3° | 55.0° |
O9 | P1 | O7 | H7 | 1.4° | 180.0° |
O9 | P1 | O8 | H8 | 21.7° | 60.0° |
O7 | P1 | O8 | O6 | 112.8° | 120.0° |
O7 | P1 | O6 | C1 | 179.5° | 65.0° |
O7 | P1 | O8 | H8 | 153.5° | 60.0° |
O8 | P1 | O6 | C1 | 57.0° | 175.0° |
O8 | P1 | O7 | H7 | 129.7° | 60.0° |
P1 | O6 | C1 | C2 | 168.0° | 180.0° |
O6 | P1 | O7 | H7 | 110.9° | 60.1° |
O6 | P1 | O8 | H8 | 93.7° | 180.0° |
P1 | O6 | C1 | H1C1 | 48.1° | 60.0° |
P1 | O6 | C1 | H1C2 | 73.1° | 60.0° |
O6 | C1 | C2 | H1C1 | 120.0° | 120.0° |
O6 | C1 | C2 | H1C2 | 118.9° | 120.0° |
O6 | C1 | C2 | O5 | 56.5° | 65.0° |
O6 | C1 | C2 | C3 | 178.6° | 175.0° |
O6 | C1 | H1C1 | H1C2 | 118.9° | 120.0° |
O6 | C1 | C2 | H2 | 61.9° | 55.1° |
C1 | C2 | O5 | C3 | 125.5° | 120.0° |
C1 | C2 | O5 | H2 | 117.7° | 120.0° |
C1 | C2 | C3 | H2 | 117.5° | 120.0° |
C1 | C2 | C3 | O4 | 54.4° | 60.0° |
C1 | C2 | C3 | C4 | 178.0° | 180.0° |
C2 | C1 | H1C1 | H1C2 | 118.8° | 120.0° |
C1 | C2 | O5 | H5 | 54.8° | 60.0° |
C1 | C2 | C3 | H3 | 65.1° | 60.0° |
O5 | C2 | C3 | H2 | 118.3° | 120.0° |
O5 | C2 | C3 | O4 | 178.6° | NaN° |
O5 | C2 | C3 | C4 | 57.8° | 60.0° |
O5 | C2 | C1 | H1C1 | 63.5° | 175.0° |
O5 | C2 | C1 | H1C2 | 175.3° | 55.0° |
O5 | C2 | C3 | H3 | 59.1° | 60.1° |
C2 | C3 | O4 | C4 | 121.0° | 120.0° |
C2 | C3 | O4 | H3 | 122.2° | 120.0° |
C2 | C3 | C4 | H3 | 122.1° | 120.0° |
C2 | C3 | C4 | O3 | 150.6° | 60.0° |
C2 | C3 | C4 | C5 | 83.9° | 180.0° |
C3 | C2 | C1 | H1C1 | 61.4° | 55.0° |
C3 | C2 | C1 | H1C2 | 59.7° | 65.0° |
C3 | C2 | O5 | H5 | 179.7° | 60.0° |
C2 | C3 | O4 | H4 | 179.7° | 60.0° |
C2 | C3 | C4 | HA | 32.4° | 60.0° |
O4 | C3 | C4 | H3 | 119.3° | 120.0° |
O4 | C3 | C4 | O3 | 90.9° | 180.0° |
O4 | C3 | C4 | C5 | 34.6° | 60.0° |
O4 | C3 | C2 | H2 | 63.1° | 60.0° |
O4 | C3 | C4 | HA | 150.9° | 60.0° |
C3 | C4 | O3 | C5 | 127.0° | 120.1° |
C3 | C4 | O3 | HA | 116.3° | 120.0° |
C3 | C4 | C5 | HA | 116.0° | 120.0° |
C3 | C4 | C5 | O1 | 97.1° | 115.0° |
C3 | C4 | C5 | O2 | 56.7° | 65.0° |
C4 | C3 | C2 | H2 | 60.4° | 60.0° |
C4 | C3 | O4 | H4 | 59.4° | 60.0° |
C3 | C4 | O3 | HB | 106.3° | 60.0° |
O3 | C4 | C5 | HA | 118.2° | 119.9° |
O3 | C4 | C5 | O1 | 28.7° | 5.0° |
O3 | C4 | C5 | O2 | 177.5° | 175.0° |
O3 | C4 | C3 | H3 | 28.4° | 60.0° |
C4 | C5 | O1 | O2 | 155.1° | 180.0° |
C5 | C4 | C3 | H3 | 153.9° | 60.0° |
C5 | C4 | O3 | HB | 126.7° | 60.0° |
C4 | C5 | O2 | HC | 157.3° | 179.9° |
O1 | C5 | C4 | HA | 146.9° | 124.9° |
O1 | C5 | O2 | HC | 0.0° | 0.1° |
O2 | C5 | C4 | HA | 59.3° | 55.0° |
H1C1 | C1 | C2 | H2 | 178.1° | 64.9° |
H1C2 | C1 | C2 | H2 | 57.0° | 175.0° |
H2 | C2 | O5 | H5 | 62.9° | 180.0° |
H2 | C2 | C3 | H3 | 177.4° | 179.9° |
H3 | C3 | O4 | H4 | 57.5° | 180.0° |
H3 | C3 | C4 | HA | 89.7° | 180.0° |
HA | C4 | O3 | HB | 10.0° | 180.0° |