9PD
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C14 | P13 | sing | 1.82Å | 1.90Å | |
| C03 | C02 | sing | 1.53Å | 1.54Å | |
| C03 | C04 | sing | 1.53Å | 1.53Å | |
| C02 | C01 | sing | 1.53Å | 1.55Å | |
| C12 | P13 | sing | 1.82Å | 1.91Å | |
| C12 | C11 | sing | 1.53Å | 1.54Å | |
| P13 | O16 | doub | 1.48Å | 1.53Å | |
| P13 | C15 | sing | 1.82Å | 1.90Å | |
| C04 | C05 | sing | 1.53Å | 1.53Å | |
| C05 | C06 | sing | 1.53Å | 1.54Å | |
| C11 | C10 | sing | 1.53Å | 1.53Å | |
| C09 | C10 | sing | 1.53Å | 1.53Å | |
| C09 | C08 | sing | 1.53Å | 1.54Å | |
| C06 | C07 | sing | 1.53Å | 1.54Å | |
| C07 | C08 | sing | 1.53Å | 1.53Å | |
| C01 | H1 | sing | 1.09Å | 1.10Å | |
| C01 | H2 | sing | 1.09Å | 1.10Å | |
| C01 | H3 | sing | 1.09Å | 1.10Å | |
| C02 | H4 | sing | 1.09Å | 1.10Å | |
| C02 | H5 | sing | 1.09Å | 1.10Å | |
| C03 | H6 | sing | 1.09Å | 1.10Å | |
| C03 | H7 | sing | 1.09Å | 1.10Å | |
| C04 | H8 | sing | 1.09Å | 1.10Å | |
| C04 | H9 | sing | 1.09Å | 1.10Å | |
| C05 | H10 | sing | 1.09Å | 1.10Å | |
| C05 | H11 | sing | 1.09Å | 1.10Å | |
| C06 | H12 | sing | 1.09Å | 1.10Å | |
| C06 | H13 | sing | 1.09Å | 1.10Å | |
| C07 | H14 | sing | 1.09Å | 1.10Å | |
| C07 | H15 | sing | 1.09Å | 1.10Å | |
| C08 | H16 | sing | 1.09Å | 1.10Å | |
| C08 | H17 | sing | 1.09Å | 1.10Å | |
| C09 | H18 | sing | 1.09Å | 1.10Å | |
| C09 | H19 | sing | 1.09Å | 1.10Å | |
| C10 | H20 | sing | 1.09Å | 1.10Å | |
| C10 | H21 | sing | 1.09Å | 1.10Å | |
| C11 | H22 | sing | 1.09Å | 1.10Å | |
| C11 | H23 | sing | 1.09Å | 1.10Å | |
| C12 | H24 | sing | 1.09Å | 1.10Å | |
| C12 | H25 | sing | 1.09Å | 1.10Å | |
| C14 | H26 | sing | 1.09Å | 1.10Å | |
| C14 | H27 | sing | 1.09Å | 1.10Å | |
| C14 | H28 | sing | 1.09Å | 1.10Å | |
| C15 | H29 | sing | 1.09Å | 1.10Å | |
| C15 | H30 | sing | 1.09Å | 1.10Å | |
| C15 | H31 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C14 | P13 | C12 | 109.2° | 109.5° |
| C14 | P13 | O16 | 110.5° | 109.5° |
| C14 | P13 | C15 | 113.0° | 109.5° |
| P13 | C14 | H26 | 109.5° | 109.5° |
| P13 | C14 | H27 | 109.5° | 109.5° |
| P13 | C14 | H28 | 109.5° | 109.5° |
| C02 | C03 | C04 | 108.9° | 109.5° |
| C03 | C02 | C01 | 117.0° | 109.4° |
| C03 | C02 | H4 | 107.6° | 109.4° |
| C03 | C02 | H5 | 107.6° | 109.5° |
| C02 | C03 | H6 | 109.6° | 109.5° |
| C02 | C03 | H7 | 109.6° | 109.5° |
| C03 | C04 | C05 | 116.1° | 109.5° |
| C04 | C03 | H6 | 109.6° | 109.4° |
| C04 | C03 | H7 | 109.6° | 109.5° |
| C03 | C04 | H8 | 107.8° | 109.5° |
| C03 | C04 | H9 | 107.8° | 109.5° |
| C02 | C01 | H1 | 109.5° | 109.4° |
| C02 | C01 | H2 | 109.4° | 109.5° |
| C02 | C01 | H3 | 109.4° | 109.5° |
| C01 | C02 | H4 | 107.6° | 109.5° |
| C01 | C02 | H5 | 107.6° | 109.5° |
| P13 | C12 | C11 | 112.9° | 109.5° |
| C12 | P13 | O16 | 111.3° | 109.5° |
| C12 | P13 | C15 | 106.6° | 109.5° |
| P13 | C12 | H24 | 108.6° | 109.5° |
| P13 | C12 | H25 | 108.6° | 109.5° |
| C12 | C11 | C10 | 111.6° | 109.5° |
| C12 | C11 | H22 | 108.9° | 109.5° |
| C12 | C11 | H23 | 108.9° | 109.5° |
| C11 | C12 | H24 | 108.6° | 109.5° |
| C11 | C12 | H25 | 108.6° | 109.5° |
| O16 | P13 | C15 | 106.0° | 109.5° |
| P13 | C15 | H29 | 109.5° | 109.5° |
| P13 | C15 | H30 | 109.5° | 109.5° |
| P13 | C15 | H31 | 109.5° | 109.5° |
| C04 | C05 | C06 | 113.9° | 109.5° |
| C05 | C04 | H8 | 107.8° | 109.4° |
| C05 | C04 | H9 | 107.8° | 109.5° |
| C04 | C05 | H10 | 108.4° | 109.4° |
| C04 | C05 | H11 | 108.4° | 109.5° |
| C05 | C06 | C07 | 109.9° | 109.5° |
| C06 | C05 | H10 | 108.4° | 109.5° |
| C06 | C05 | H11 | 108.4° | 109.5° |
| C05 | C06 | H12 | 109.4° | 109.4° |
| C05 | C06 | H13 | 109.4° | 109.4° |
| C11 | C10 | C09 | 113.2° | 109.5° |
| C11 | C10 | H20 | 108.5° | 109.4° |
| C11 | C10 | H21 | 108.6° | 109.4° |
| C10 | C11 | H22 | 109.0° | 109.4° |
| C10 | C11 | H23 | 109.0° | 109.4° |
| C10 | C09 | C08 | 106.8° | 109.4° |
| C10 | C09 | H18 | 110.2° | 109.5° |
| C10 | C09 | H19 | 110.1° | 109.5° |
| C09 | C10 | H20 | 108.5° | 109.5° |
| C09 | C10 | H21 | 108.5° | 109.5° |
| C09 | C08 | C07 | 115.1° | 109.4° |
| C09 | C08 | H16 | 108.0° | 109.5° |
| C09 | C08 | H17 | 108.0° | 109.5° |
| C08 | C09 | H18 | 110.2° | 109.5° |
| C08 | C09 | H19 | 110.2° | 109.5° |
| C06 | C07 | C08 | 115.5° | 109.4° |
| C07 | C06 | H12 | 109.4° | 109.5° |
| C07 | C06 | H13 | 109.4° | 109.5° |
| C06 | C07 | H14 | 107.9° | 109.5° |
| C06 | C07 | H15 | 107.9° | 109.5° |
| C08 | C07 | H14 | 108.0° | 109.4° |
| C08 | C07 | H15 | 107.9° | 109.5° |
| C07 | C08 | H16 | 108.0° | 109.5° |
| C07 | C08 | H17 | 108.0° | 109.5° |
| H1 | C01 | H2 | 109.5° | 109.5° |
| H1 | C01 | H3 | 109.4° | 109.5° |
| H2 | C01 | H3 | 109.5° | 109.5° |
| H4 | C02 | H5 | 109.5° | 109.5° |
| H6 | C03 | H7 | 109.4° | 109.4° |
| H8 | C04 | H9 | 109.5° | 109.5° |
| H10 | C05 | H11 | 109.4° | 109.5° |
| H12 | C06 | H13 | 109.5° | 109.5° |
| H14 | C07 | H15 | 109.5° | 109.5° |
| H16 | C08 | H17 | 109.5° | 109.5° |
| H18 | C09 | H19 | 109.4° | 109.5° |
| H20 | C10 | H21 | 109.5° | 109.5° |
| H22 | C11 | H23 | 109.5° | 109.4° |
| H24 | C12 | H25 | 109.4° | 109.5° |
| H26 | C14 | H27 | 109.5° | 109.5° |
| H26 | C14 | H28 | 109.4° | 109.5° |
| H27 | C14 | H28 | 109.4° | 109.5° |
| H29 | C15 | H30 | 109.5° | 109.4° |
| H29 | C15 | H31 | 109.4° | 109.5° |
| H30 | C15 | H31 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C14 | P13 | C12 | O16 | 122.3° | 120.0° |
| C14 | P13 | C12 | C15 | 122.5° | 120.0° |
| C14 | P13 | C12 | C11 | 172.2° | 175.0° |
| C14 | P13 | O16 | C15 | 122.8° | 120.0° |
| C14 | P13 | C12 | H24 | 67.3° | 55.0° |
| C14 | P13 | C12 | H25 | 51.7° | 65.0° |
| P13 | C14 | H26 | H27 | 120.0° | 120.0° |
| P13 | C14 | H26 | H28 | 120.0° | 120.0° |
| P13 | C14 | H27 | H28 | 120.0° | 120.0° |
| C14 | P13 | C15 | H29 | 180.0° | 180.0° |
| C14 | P13 | C15 | H30 | 60.0° | 60.0° |
| C14 | P13 | C15 | H31 | 60.0° | 60.0° |
| C02 | C03 | C04 | H6 | 119.9° | 120.0° |
| C02 | C03 | C04 | H7 | 119.9° | 120.0° |
| C03 | C02 | C01 | H4 | 121.1° | 120.0° |
| C03 | C02 | C01 | H5 | 121.1° | 120.0° |
| C02 | C03 | C04 | C05 | 175.8° | 180.0° |
| C03 | C02 | C01 | H1 | 180.0° | 180.0° |
| C03 | C02 | C01 | H2 | 60.0° | 60.0° |
| C03 | C02 | C01 | H3 | 60.0° | 60.0° |
| C03 | C02 | H4 | H5 | 116.6° | 120.0° |
| C02 | C03 | H6 | H7 | 120.2° | 120.0° |
| C02 | C03 | C04 | H8 | 54.8° | 60.0° |
| C02 | C03 | C04 | H9 | 63.3° | 60.0° |
| C04 | C03 | C02 | C01 | 84.6° | 180.0° |
| C03 | C04 | C05 | H8 | 121.0° | 120.0° |
| C03 | C04 | C05 | H9 | 120.9° | 120.0° |
| C03 | C04 | C05 | C06 | 140.9° | 180.0° |
| C04 | C03 | C02 | H4 | 154.3° | 60.0° |
| C04 | C03 | C02 | H5 | 36.4° | 60.0° |
| C04 | C03 | H6 | H7 | 120.3° | 120.0° |
| C03 | C04 | H8 | H9 | 117.0° | 120.0° |
| C03 | C04 | C05 | H10 | 98.4° | 60.0° |
| C03 | C04 | C05 | H11 | 20.3° | 60.0° |
| C02 | C01 | H1 | H2 | 120.0° | 120.0° |
| C02 | C01 | H1 | H3 | 120.0° | 120.0° |
| C02 | C01 | H2 | H3 | 120.0° | 120.1° |
| C01 | C02 | H4 | H5 | 116.6° | 120.0° |
| C01 | C02 | C03 | H6 | 155.4° | 60.0° |
| C01 | C02 | C03 | H7 | 35.3° | 60.0° |
| P13 | C12 | C11 | H24 | 120.5° | 120.0° |
| P13 | C12 | C11 | H25 | 120.5° | 120.0° |
| C12 | P13 | O16 | C15 | 115.6° | 120.0° |
| P13 | C12 | C11 | C10 | 62.6° | 180.0° |
| P13 | C12 | C11 | H22 | 177.1° | 60.0° |
| P13 | C12 | C11 | H23 | 57.7° | 60.0° |
| P13 | C12 | H24 | H25 | 118.5° | 120.0° |
| C12 | P13 | C14 | H26 | 180.0° | 60.0° |
| C12 | P13 | C14 | H27 | 60.0° | 180.0° |
| C12 | P13 | C14 | H28 | 60.0° | 60.0° |
| C12 | P13 | C15 | H29 | 60.0° | 60.0° |
| C12 | P13 | C15 | H30 | 60.0° | 180.0° |
| C12 | P13 | C15 | H31 | 180.0° | 60.0° |
| C11 | C12 | P13 | O16 | 65.5° | 55.0° |
| C11 | C12 | P13 | C15 | 49.7° | 65.0° |
| C12 | C11 | C10 | H22 | 120.3° | 120.0° |
| C12 | C11 | C10 | H23 | 120.3° | 120.1° |
| C12 | C11 | C10 | C09 | 93.2° | 180.0° |
| C12 | C11 | C10 | H20 | 146.3° | 60.0° |
| C12 | C11 | C10 | H21 | 27.4° | 59.9° |
| C12 | C11 | H22 | H23 | 119.0° | 120.1° |
| C11 | C12 | H24 | H25 | 118.4° | 120.0° |
| O16 | P13 | C12 | H24 | 55.0° | 65.0° |
| O16 | P13 | C12 | H25 | 174.0° | 175.0° |
| O16 | P13 | C14 | H26 | 57.2° | 180.0° |
| O16 | P13 | C14 | H27 | 177.2° | 60.0° |
| O16 | P13 | C14 | H28 | 62.8° | 60.0° |
| O16 | P13 | C15 | H29 | 58.7° | 60.0° |
| O16 | P13 | C15 | H30 | 178.8° | 60.0° |
| O16 | P13 | C15 | H31 | 61.2° | 180.0° |
| C15 | P13 | C12 | H24 | 170.2° | 175.0° |
| C15 | P13 | C12 | H25 | 70.8° | 55.0° |
| C15 | P13 | C14 | H26 | 61.5° | 60.0° |
| C15 | P13 | C14 | H27 | 58.5° | 60.0° |
| C15 | P13 | C14 | H28 | 178.5° | 180.0° |
| P13 | C15 | H29 | H30 | 120.0° | 120.0° |
| P13 | C15 | H29 | H31 | 120.0° | 120.0° |
| P13 | C15 | H30 | H31 | 120.0° | 120.0° |
| C04 | C05 | C06 | H10 | 120.7° | 120.0° |
| C04 | C05 | C06 | H11 | 120.7° | 120.0° |
| C04 | C05 | C06 | C07 | 140.0° | 180.0° |
| C05 | C04 | C03 | H6 | 64.3° | 60.0° |
| C05 | C04 | C03 | H7 | 55.9° | 60.0° |
| C05 | C04 | H8 | H9 | 117.0° | 120.0° |
| C04 | C05 | H10 | H11 | 118.0° | 120.0° |
| C04 | C05 | C06 | H12 | 19.9° | 60.0° |
| C04 | C05 | C06 | H13 | 99.9° | 59.9° |
| C05 | C06 | C07 | H12 | 120.1° | 120.0° |
| C05 | C06 | C07 | H13 | 120.1° | 120.0° |
| C05 | C06 | C07 | C08 | 118.8° | 180.0° |
| C06 | C05 | C04 | H8 | 20.0° | 60.0° |
| C06 | C05 | C04 | H9 | 98.1° | 60.0° |
| C06 | C05 | H10 | H11 | 118.0° | 120.0° |
| C05 | C06 | H12 | H13 | 119.8° | 119.9° |
| C05 | C06 | C07 | H14 | 2.1° | 60.0° |
| C05 | C06 | C07 | H15 | 120.4° | 60.0° |
| C11 | C10 | C09 | H20 | 120.5° | 120.0° |
| C11 | C10 | C09 | H21 | 120.6° | 120.0° |
| C11 | C10 | C09 | C08 | 138.8° | 180.0° |
| C11 | C10 | C09 | H18 | 101.6° | 60.0° |
| C11 | C10 | C09 | H19 | 19.2° | 60.0° |
| C11 | C10 | H20 | H21 | 118.3° | 119.9° |
| C10 | C11 | H22 | H23 | 119.1° | 119.9° |
| C10 | C11 | C12 | H24 | 57.9° | 60.0° |
| C10 | C11 | C12 | H25 | 176.9° | 60.0° |
| C10 | C09 | C08 | H18 | 119.6° | 120.0° |
| C10 | C09 | C08 | H19 | 119.6° | 120.0° |
| C10 | C09 | C08 | C07 | 172.7° | 180.0° |
| C10 | C09 | C08 | H16 | 51.9° | 60.0° |
| C10 | C09 | C08 | H17 | 66.4° | 60.0° |
| C10 | C09 | H18 | H19 | 121.2° | 120.0° |
| C09 | C10 | H20 | H21 | 118.3° | 120.1° |
| C09 | C10 | C11 | H22 | 27.2° | 60.0° |
| C09 | C10 | C11 | H23 | 146.6° | 59.9° |
| C09 | C08 | C07 | C06 | 83.0° | 180.0° |
| C09 | C08 | C07 | H16 | 120.8° | 120.0° |
| C09 | C08 | C07 | H17 | 120.8° | 120.0° |
| C09 | C08 | C07 | H14 | 37.8° | 60.0° |
| C09 | C08 | C07 | H15 | 156.1° | 60.0° |
| C09 | C08 | H16 | H17 | 117.4° | 120.0° |
| C08 | C09 | H18 | H19 | 121.3° | 120.0° |
| C08 | C09 | C10 | H20 | 18.3° | 60.0° |
| C08 | C09 | C10 | H21 | 100.6° | 60.0° |
| C06 | C07 | C08 | H14 | 120.9° | 120.0° |
| C06 | C07 | C08 | H15 | 120.9° | 120.0° |
| C07 | C06 | C05 | H10 | 99.3° | 60.0° |
| C07 | C06 | C05 | H11 | 19.3° | 60.0° |
| C07 | C06 | H12 | H13 | 119.8° | 120.1° |
| C06 | C07 | H14 | H15 | 117.2° | 120.0° |
| C06 | C07 | C08 | H16 | 37.8° | 60.0° |
| C06 | C07 | C08 | H17 | 156.1° | 60.0° |
| C08 | C07 | C06 | H12 | 121.2° | 60.0° |
| C08 | C07 | C06 | H13 | 1.3° | 60.0° |
| C08 | C07 | H14 | H15 | 117.2° | 120.0° |
| C07 | C08 | H16 | H17 | 117.4° | 120.0° |
| C07 | C08 | C09 | H18 | 67.7° | 60.0° |
| C07 | C08 | C09 | H19 | 53.2° | 60.0° |
| H1 | C01 | H2 | H3 | 120.0° | 120.0° |
| H1 | C01 | C02 | H4 | 58.9° | 60.0° |
| H1 | C01 | C02 | H5 | 58.9° | 60.0° |
| H2 | C01 | C02 | H4 | 178.9° | 59.9° |
| H2 | C01 | C02 | H5 | 61.1° | 180.0° |
| H3 | C01 | C02 | H4 | 61.1° | 180.0° |
| H3 | C01 | C02 | H5 | 178.9° | 59.9° |
| H4 | C02 | C03 | H6 | 34.3° | 180.0° |
| H4 | C02 | C03 | H7 | 85.8° | 60.0° |
| H5 | C02 | C03 | H6 | 83.5° | 60.0° |
| H5 | C02 | C03 | H7 | 156.4° | 180.0° |
| H6 | C03 | C04 | H8 | 174.8° | 179.9° |
| H6 | C03 | C04 | H9 | 56.7° | 60.1° |
| H7 | C03 | C04 | H8 | 65.1° | 60.0° |
| H7 | C03 | C04 | H9 | 176.8° | NaN° |
| H8 | C04 | C05 | H10 | 140.6° | 180.0° |
| H8 | C04 | C05 | H11 | 100.7° | 60.0° |
| H9 | C04 | C05 | H10 | 22.5° | 60.0° |
| H9 | C04 | C05 | H11 | 141.2° | 180.0° |
| H10 | C05 | C06 | H12 | 140.6° | 180.0° |
| H10 | C05 | C06 | H13 | 20.7° | 60.0° |
| H11 | C05 | C06 | H12 | 100.7° | 60.0° |
| H11 | C05 | C06 | H13 | 139.4° | 180.0° |
| H12 | C06 | C07 | H14 | 117.9° | 180.0° |
| H12 | C06 | C07 | H15 | 0.3° | 60.0° |
| H13 | C06 | C07 | H14 | 122.2° | 60.0° |
| H13 | C06 | C07 | H15 | 119.6° | 180.0° |
| H14 | C07 | C08 | H16 | 158.7° | 180.0° |
| H14 | C07 | C08 | H17 | 83.0° | 60.0° |
| H15 | C07 | C08 | H16 | 83.1° | 60.0° |
| H15 | C07 | C08 | H17 | 35.2° | 180.0° |
| H16 | C08 | C09 | H18 | 171.5° | 180.0° |
| H16 | C08 | C09 | H19 | 67.7° | 60.0° |
| H17 | C08 | C09 | H18 | 53.2° | 60.0° |
| H17 | C08 | C09 | H19 | 174.0° | 180.0° |
| H18 | C09 | C10 | H20 | 137.8° | 180.0° |
| H18 | C09 | C10 | H21 | 19.0° | 59.9° |
| H19 | C09 | C10 | H20 | 101.3° | 59.9° |
| H19 | C09 | C10 | H21 | 139.8° | 180.0° |
| H20 | C10 | C11 | H22 | 93.4° | 180.0° |
| H20 | C10 | C11 | H23 | 26.0° | 60.1° |
| H21 | C10 | C11 | H22 | 147.7° | 60.1° |
| H21 | C10 | C11 | H23 | 92.9° | 180.0° |
| H22 | C11 | C12 | H24 | 62.4° | 180.0° |
| H22 | C11 | C12 | H25 | 56.6° | 60.0° |
| H23 | C11 | C12 | H24 | 178.2° | 60.0° |
| H23 | C11 | C12 | H25 | 62.8° | 180.0° |
| H26 | C14 | H27 | H28 | 120.0° | 120.0° |
| H29 | C15 | H30 | H31 | 119.9° | 120.0° |
