Obsolete: I8Z
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
O15 | P14 | doub | 1.48Å | 1.51Å | |
P08 | O07 | sing | 1.63Å | 1.65Å | |
P08 | O10 | sing | 1.63Å | 1.33Å | |
P08 | O11 | doub | 1.48Å | 1.65Å | |
P14 | O13 | sing | 1.61Å | 1.65Å | |
P14 | O16 | sing | 1.61Å | 1.51Å | |
P14 | O17 | sing | 1.61Å | 1.51Å | |
C01 | C02 | sing | 1.53Å | 1.42Å | |
C01 | O13 | sing | 1.43Å | 1.40Å | |
C02 | O06 | sing | 1.43Å | 1.36Å | |
C03 | C04 | sing | 1.55Å | 1.21Å | |
C03 | O12 | sing | 1.43Å | 1.47Å | |
C05 | O06 | sing | 1.43Å | 1.49Å | |
O16 | H4 | sing | 0.97Å | 0.95Å | |
O17 | H5 | sing | 0.97Å | 0.95Å | |
C02 | C03 | sing | 1.54Å | 1.73Å | |
C05 | C04 | sing | 1.55Å | 1.71Å | |
C05 | O07 | sing | 1.44Å | 1.21Å | |
C04 | O10 | sing | 1.45Å | 1.46Å | |
P08 | O09 | sing | 1.61Å | 1.46Å | |
C01 | H1 | sing | 1.09Å | 1.10Å | |
C01 | H2 | sing | 1.09Å | 1.10Å | |
C02 | H3 | sing | 1.09Å | 1.10Å | |
C03 | H6 | sing | 1.09Å | 1.10Å | |
C04 | H7 | sing | 1.09Å | 1.10Å | |
C05 | H8 | sing | 1.09Å | 1.10Å | |
O09 | H9 | sing | 0.97Å | 0.95Å | |
O12 | H10 | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O15 | P14 | O13 | 109.4° | 109.5° |
O15 | P14 | O16 | 109.2° | 109.5° |
O15 | P14 | O17 | 109.3° | 109.5° |
O07 | P08 | O10 | 111.1° | 103.9° |
O07 | P08 | O11 | 108.7° | 110.5° |
P08 | O07 | C05 | 108.4° | 104.9° |
O07 | P08 | O09 | 109.7° | 110.5° |
O10 | P08 | O11 | 109.2° | 110.6° |
P08 | O10 | C04 | 106.8° | 102.8° |
O10 | P08 | O09 | 109.3° | 110.5° |
O11 | P08 | O09 | 108.8° | 110.6° |
O13 | P14 | O16 | 109.6° | 109.5° |
O13 | P14 | O17 | 109.7° | 109.5° |
P14 | O13 | C01 | 118.7° | 122.9° |
O16 | P14 | O17 | 109.7° | 109.5° |
P14 | O16 | H4 | 109.5° | 114.0° |
P14 | O17 | H5 | 109.5° | 114.0° |
C02 | C01 | O13 | 109.0° | 109.4° |
C01 | C02 | O06 | 110.4° | 109.8° |
C01 | C02 | C03 | 110.8° | 109.8° |
C02 | C01 | H1 | 109.6° | 109.5° |
C02 | C01 | H2 | 109.6° | 109.5° |
C01 | C02 | H3 | 110.9° | 109.9° |
O13 | C01 | H1 | 109.6° | 109.5° |
O13 | C01 | H2 | 109.6° | 109.5° |
C02 | O06 | C05 | 105.2° | 110.3° |
O06 | C02 | C03 | 105.4° | 107.6° |
O06 | C02 | H3 | 112.0° | 109.8° |
C04 | C03 | O12 | 109.9° | 110.8° |
C04 | C03 | C02 | 106.4° | 102.6° |
C03 | C04 | C05 | 105.7° | 101.1° |
C03 | C04 | O10 | 112.1° | 107.6° |
C04 | C03 | H6 | 114.0° | 110.8° |
C03 | C04 | H7 | 114.8° | 113.6° |
O12 | C03 | C02 | 110.1° | 110.8° |
O12 | C03 | H6 | 109.7° | 110.8° |
C03 | O12 | H10 | 109.5° | 114.0° |
O06 | C05 | C04 | 105.7° | 105.7° |
O06 | C05 | O07 | 111.9° | 110.0° |
O06 | C05 | H8 | 110.1° | 110.9° |
C03 | C02 | H3 | 107.1° | 109.9° |
C02 | C03 | H6 | 106.6° | 110.8° |
C04 | C05 | O07 | 106.3° | 107.7° |
C05 | C04 | O10 | 105.9° | 105.8° |
C05 | C04 | H7 | 107.3° | 114.4° |
C04 | C05 | H8 | 107.4° | 110.9° |
O07 | C05 | H8 | 114.9° | 111.5° |
O10 | C04 | H7 | 110.4° | 113.3° |
P08 | O09 | H9 | 109.5° | 114.0° |
H1 | C01 | H2 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O15 | P14 | O13 | O16 | 119.7° | 120.0° |
O15 | P14 | O13 | O17 | 119.8° | 120.0° |
O15 | P14 | O16 | O17 | 119.7° | 120.0° |
O15 | P14 | O13 | C01 | 137.5° | 55.0° |
O15 | P14 | O16 | H4 | 0.0° | 59.9° |
O15 | P14 | O17 | H5 | 0.0° | 180.0° |
O07 | P08 | O10 | O11 | 119.9° | 118.6° |
O07 | P08 | O10 | O09 | 121.2° | 118.6° |
O07 | P08 | O11 | O09 | 119.4° | 122.7° |
P08 | O07 | C05 | O06 | 103.9° | 91.6° |
P08 | O07 | C05 | C04 | 11.0° | 23.1° |
O07 | P08 | O10 | C04 | 8.3° | 22.2° |
P08 | O07 | C05 | H8 | 129.6° | 145.0° |
O07 | P08 | O09 | H9 | 118.8° | 60.0° |
O10 | P08 | O11 | O09 | 119.3° | 122.8° |
P08 | O10 | C04 | C03 | 112.7° | 143.8° |
P08 | O10 | C04 | C05 | 2.1° | 36.3° |
O10 | P08 | O07 | C05 | 13.8° | 1.3° |
P08 | O10 | C04 | H7 | 118.0° | 89.8° |
O10 | P08 | O09 | H9 | 119.2° | 174.5° |
O11 | P08 | O07 | C05 | 134.0° | 119.9° |
O11 | P08 | O10 | C04 | 128.2° | 96.5° |
O11 | P08 | O09 | H9 | 0.0° | 62.8° |
O13 | P14 | O16 | O17 | 120.4° | 120.0° |
P14 | O13 | C01 | C02 | 160.9° | 180.0° |
O13 | P14 | O16 | H4 | 119.8° | 179.9° |
O13 | P14 | O17 | H5 | 119.9° | 60.0° |
P14 | O13 | C01 | H1 | 41.0° | 60.1° |
P14 | O13 | C01 | H2 | 79.1° | 60.0° |
O16 | P14 | O13 | C01 | 17.8° | 175.0° |
O16 | P14 | O17 | H5 | 119.7° | 60.0° |
O17 | P14 | O13 | C01 | 102.7° | 65.0° |
O17 | P14 | O16 | H4 | 119.7° | 60.1° |
C02 | C01 | O13 | H1 | 119.9° | 120.0° |
C02 | C01 | O13 | H2 | 119.9° | 120.0° |
C01 | C02 | O06 | C03 | 119.7° | 119.5° |
C01 | C02 | O06 | H3 | 124.2° | 120.9° |
C01 | C02 | C03 | C04 | 156.0° | 140.8° |
C01 | C02 | C03 | O12 | 85.0° | 100.9° |
C01 | C02 | O06 | C05 | 148.9° | 119.0° |
C01 | C02 | C03 | H3 | 121.1° | 121.0° |
C02 | C01 | H1 | H2 | 120.2° | 120.0° |
C01 | C02 | C03 | H6 | 33.9° | 22.5° |
O13 | C01 | C02 | O06 | 45.0° | 66.5° |
O13 | C01 | C02 | C03 | 71.4° | 175.4° |
O13 | C01 | H1 | H2 | 120.3° | 120.0° |
O13 | C01 | C02 | H3 | 169.8° | 54.4° |
O06 | C02 | C03 | C04 | 36.6° | 21.3° |
O06 | C02 | C03 | O12 | 155.6° | 139.6° |
O06 | C02 | C03 | H3 | 119.5° | 119.5° |
C02 | O06 | C05 | C04 | 17.4° | 22.4° |
C02 | O06 | C05 | O07 | 97.9° | 138.3° |
O06 | C02 | C01 | H1 | 74.9° | 173.5° |
O06 | C02 | C01 | H2 | 164.9° | 53.5° |
O06 | C02 | C03 | H6 | 85.5° | 96.9° |
C02 | O06 | C05 | H8 | 133.0° | 97.9° |
C04 | C03 | O12 | C02 | 116.9° | 113.2° |
C04 | C03 | O12 | H6 | 126.1° | 123.4° |
C03 | C04 | C05 | O06 | 6.9° | 34.4° |
C04 | C03 | C02 | H6 | 122.0° | 118.3° |
C03 | C04 | C05 | O10 | 119.1° | 112.1° |
C03 | C04 | C05 | H7 | 122.9° | 122.4° |
C03 | C04 | C05 | O07 | 125.9° | 152.0° |
C03 | C04 | O10 | H7 | 129.3° | 126.4° |
C04 | C03 | C02 | H3 | 82.9° | 98.2° |
C03 | C04 | C05 | H8 | 110.6° | 85.8° |
C04 | C03 | O12 | H10 | 180.0° | 174.7° |
O12 | C03 | C02 | H6 | 118.9° | 123.4° |
O12 | C03 | C04 | C05 | 142.0° | 151.1° |
O12 | C03 | C04 | O10 | 27.0° | 40.4° |
O12 | C03 | C02 | H3 | 36.1° | 20.1° |
O12 | C03 | C04 | H7 | 100.0° | 85.9° |
C05 | O06 | C02 | C03 | 29.3° | 0.5° |
O06 | C05 | C04 | O07 | 119.0° | 117.6° |
O06 | C05 | C04 | H8 | 117.5° | 120.2° |
O06 | C05 | O07 | H8 | 126.5° | 123.5° |
O06 | C05 | C04 | O10 | 112.2° | 77.7° |
C05 | O06 | C02 | H3 | 86.9° | 120.0° |
O06 | C05 | C04 | H7 | 129.8° | 156.8° |
C02 | C03 | C04 | C05 | 22.8° | 32.8° |
C02 | C03 | C04 | O10 | 92.2° | 77.9° |
C03 | C02 | C01 | H1 | 168.7° | 55.4° |
C03 | C02 | C01 | H2 | 48.5° | 64.6° |
C02 | C03 | C04 | H7 | 140.8° | 155.8° |
C02 | C03 | O12 | H10 | 63.1° | 61.4° |
C04 | C05 | O07 | H8 | 118.6° | 121.8° |
C05 | C04 | O10 | H7 | 115.9° | 126.1° |
C05 | C04 | C03 | H6 | 94.4° | 85.5° |
O07 | C05 | C04 | O10 | 6.8° | 39.9° |
C05 | O07 | P08 | O09 | 107.1° | 117.3° |
O07 | C05 | C04 | H7 | 111.1° | 85.6° |
C04 | O10 | P08 | O09 | 112.9° | 140.7° |
O10 | C04 | C03 | H6 | 150.6° | 163.8° |
O10 | C04 | C05 | H8 | 130.3° | 162.1° |
H1 | C01 | C02 | H3 | 49.9° | 65.6° |
H2 | C01 | C02 | H3 | 70.3° | 174.4° |
H3 | C02 | C03 | H6 | 155.0° | 143.5° |
H6 | C03 | C04 | H7 | 23.6° | 37.5° |
H6 | C03 | O12 | H10 | 53.9° | 62.0° |
H7 | C04 | C05 | H8 | 12.3° | 36.6° |