8YP
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C8 | C7 | sing | 1.53Å | 1.54Å | |
C7 | C6 | sing | 1.53Å | 1.56Å | |
C5 | C6 | sing | 1.53Å | 1.53Å | |
C5 | C4 | sing | 1.53Å | 1.54Å | |
C1 | C2 | sing | 1.53Å | 1.55Å | |
C3 | C4 | sing | 1.53Å | 1.54Å | |
C3 | C2 | sing | 1.53Å | 1.54Å | |
C1 | H2 | sing | 1.09Å | 1.10Å | |
C1 | H3 | sing | 1.09Å | 1.10Å | |
C1 | H1 | sing | 1.09Å | 1.10Å | |
C2 | H4 | sing | 1.09Å | 1.10Å | |
C2 | H5 | sing | 1.09Å | 1.10Å | |
C3 | H7 | sing | 1.09Å | 1.10Å | |
C3 | H6 | sing | 1.09Å | 1.10Å | |
C4 | H9 | sing | 1.09Å | 1.10Å | |
C4 | H8 | sing | 1.09Å | 1.10Å | |
C5 | H11 | sing | 1.09Å | 1.10Å | |
C5 | H10 | sing | 1.09Å | 1.10Å | |
C6 | H13 | sing | 1.09Å | 1.10Å | |
C6 | H12 | sing | 1.09Å | 1.10Å | |
C7 | H15 | sing | 1.09Å | 1.10Å | |
C7 | H14 | sing | 1.09Å | 1.10Å | |
C8 | H17 | sing | 1.09Å | 1.10Å | |
C8 | H18 | sing | 1.09Å | 1.10Å | |
C8 | C9 | sing | 1.53Å | 47.24Å | |
C9 | C10 | sing | 1.51Å | 0.00Å | |
C10 | O1 | doub | 1.21Å | 0.00Å | |
C9 | H16 | sing | 1.09Å | 0.00Å | |
C9 | H19 | sing | 1.09Å | 0.00Å | |
C10 | H20 | sing | 1.08Å | 0.00Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C8 | C7 | C6 | 110.4° | 109.5° |
C8 | C7 | H15 | 109.3° | 109.4° |
C8 | C7 | H14 | 109.2° | 109.5° |
C7 | C8 | H17 | 107.5° | 109.5° |
C7 | C8 | H18 | 107.6° | 109.5° |
C7 | C8 | C9 | 117.1° | 109.5° |
C7 | C6 | C5 | 115.1° | 109.5° |
C7 | C6 | H13 | 108.0° | 109.5° |
C7 | C6 | H12 | 108.0° | 109.5° |
C6 | C7 | H15 | 109.2° | 109.5° |
C6 | C7 | H14 | 109.2° | 109.5° |
C6 | C5 | C4 | 107.4° | 109.5° |
C6 | C5 | H11 | 110.0° | 109.5° |
C6 | C5 | H10 | 110.0° | 109.4° |
C5 | C6 | H13 | 108.0° | 109.5° |
C5 | C6 | H12 | 108.0° | 109.4° |
C5 | C4 | C3 | 111.4° | 109.4° |
C5 | C4 | H9 | 108.9° | 109.5° |
C5 | C4 | H8 | 109.0° | 109.4° |
C4 | C5 | H11 | 109.9° | 109.5° |
C4 | C5 | H10 | 110.0° | 109.5° |
C1 | C2 | C3 | 111.6° | 109.4° |
C2 | C1 | H2 | 109.5° | 109.5° |
C2 | C1 | H3 | 109.5° | 109.5° |
C2 | C1 | H1 | 109.4° | 109.5° |
C1 | C2 | H4 | 109.0° | 109.5° |
C1 | C2 | H5 | 108.9° | 109.4° |
C4 | C3 | C2 | 111.7° | 109.4° |
C4 | C3 | H7 | 108.9° | 109.5° |
C4 | C3 | H6 | 108.9° | 109.5° |
C3 | C4 | H9 | 109.0° | 109.4° |
C3 | C4 | H8 | 109.0° | 109.5° |
C3 | C2 | H4 | 108.9° | 109.5° |
C3 | C2 | H5 | 108.9° | 109.5° |
C2 | C3 | H7 | 108.9° | 109.5° |
C2 | C3 | H6 | 108.9° | 109.5° |
H2 | C1 | H3 | 109.5° | 109.4° |
H2 | C1 | H1 | 109.5° | 109.5° |
H3 | C1 | H1 | 109.5° | 109.5° |
H4 | C2 | H5 | 109.5° | 109.5° |
H7 | C3 | H6 | 109.5° | 109.4° |
H9 | C4 | H8 | 109.5° | 109.5° |
H11 | C5 | H10 | 109.5° | 109.4° |
H13 | C6 | H12 | 109.5° | 109.4° |
H15 | C7 | H14 | 109.5° | 109.5° |
H17 | C8 | H18 | 109.5° | 109.5° |
H17 | C8 | C9 | 107.5° | 109.4° |
H18 | C8 | C9 | 107.5° | 109.4° |
C8 | C9 | C10 | 90.0° | 109.5° |
C8 | C9 | H16 | 90.0° | 109.4° |
C8 | C9 | H19 | 90.0° | 109.4° |
C9 | C10 | O1 | 90.0° | 120.0° |
C10 | C9 | H16 | 90.0° | 109.5° |
C10 | C9 | H19 | 90.0° | 109.4° |
C9 | C10 | H20 | 90.0° | 120.1° |
O1 | C10 | H20 | 90.0° | 120.0° |
H16 | C9 | H19 | 90.0° | 109.4° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C8 | C7 | C6 | H15 | 120.2° | 120.0° |
C8 | C7 | C6 | H14 | 120.1° | 120.0° |
C8 | C7 | C6 | C5 | 128.0° | 180.0° |
C8 | C7 | C6 | H13 | 7.1° | 60.0° |
C8 | C7 | C6 | H12 | 111.2° | 60.0° |
C8 | C7 | H15 | H14 | 119.5° | 120.0° |
C7 | C8 | H17 | H18 | 116.6° | 120.0° |
C7 | C8 | H17 | C9 | 126.9° | 120.0° |
C7 | C8 | H18 | C9 | 126.9° | 120.1° |
C7 | C8 | C9 | C10 | 90.0° | 180.0° |
C7 | C8 | C9 | H16 | 90.0° | 60.0° |
C7 | C8 | C9 | H19 | 90.0° | 60.0° |
C7 | C6 | C5 | H13 | 120.8° | 120.1° |
C7 | C6 | C5 | H12 | 120.8° | 120.0° |
C7 | C6 | C5 | C4 | 150.6° | 180.0° |
C7 | C6 | C5 | H11 | 89.8° | 59.9° |
C7 | C6 | C5 | H10 | 30.9° | 60.0° |
C7 | C6 | H13 | H12 | 117.4° | 120.0° |
C6 | C7 | H15 | H14 | 119.6° | 120.0° |
C6 | C7 | C8 | H17 | 49.7° | 60.0° |
C6 | C7 | C8 | H18 | 68.1° | 60.0° |
C6 | C7 | C8 | C9 | 170.8° | 180.0° |
C6 | C5 | C4 | H11 | 119.7° | 120.0° |
C6 | C5 | C4 | H10 | 119.7° | 120.0° |
C6 | C5 | C4 | C3 | 178.5° | 180.0° |
C6 | C5 | C4 | H9 | 58.2° | 60.0° |
C6 | C5 | C4 | H8 | 61.2° | 60.1° |
C6 | C5 | H11 | H10 | 121.0° | 120.0° |
C5 | C6 | H13 | H12 | 117.4° | 119.9° |
C5 | C6 | C7 | H15 | 111.9° | 60.0° |
C5 | C6 | C7 | H14 | 7.8° | 60.0° |
C5 | C4 | C3 | H9 | 120.3° | 120.0° |
C5 | C4 | C3 | H8 | 120.3° | 120.0° |
C5 | C4 | C3 | C2 | 145.8° | NaN° |
C5 | C4 | C3 | H7 | 93.9° | 60.0° |
C5 | C4 | C3 | H6 | 25.4° | 60.0° |
C5 | C4 | H9 | H8 | 119.1° | 120.0° |
C4 | C5 | H11 | H10 | 120.9° | 120.0° |
C4 | C5 | C6 | H13 | 29.8° | 59.9° |
C4 | C5 | C6 | H12 | 88.6° | 60.0° |
C1 | C2 | C3 | C4 | 101.2° | NaN° |
C1 | C2 | C3 | H4 | 120.3° | 120.0° |
C1 | C2 | C3 | H5 | 120.3° | 119.9° |
C2 | C1 | H2 | H3 | 120.0° | 120.0° |
C2 | C1 | H2 | H1 | 120.0° | 120.0° |
C2 | C1 | H3 | H1 | 120.0° | 120.0° |
C1 | C2 | H4 | H5 | 119.1° | 119.9° |
C1 | C2 | C3 | H7 | 138.5° | 60.0° |
C1 | C2 | C3 | H6 | 19.2° | 60.0° |
C4 | C3 | C2 | H7 | 120.3° | 120.0° |
C4 | C3 | C2 | H6 | 120.4° | 120.0° |
C4 | C3 | C2 | H4 | 138.5° | 60.0° |
C4 | C3 | C2 | H5 | 19.1° | 60.1° |
C4 | C3 | H7 | H6 | 119.0° | 120.0° |
C3 | C4 | H9 | H8 | 119.1° | 120.0° |
C3 | C4 | C5 | H11 | 61.8° | 60.0° |
C3 | C4 | C5 | H10 | 58.8° | 60.0° |
C3 | C2 | C1 | H2 | 180.0° | 60.0° |
C3 | C2 | C1 | H3 | 60.0° | 180.0° |
C3 | C2 | C1 | H1 | 60.0° | 60.0° |
C3 | C2 | H4 | H5 | 119.0° | 120.1° |
C2 | C3 | H7 | H6 | 118.9° | 120.0° |
C2 | C3 | C4 | H9 | 25.5° | 60.0° |
C2 | C3 | C4 | H8 | 93.9° | 60.0° |
H2 | C1 | H3 | H1 | 120.0° | 120.0° |
H2 | C1 | C2 | H4 | 59.7° | 179.9° |
H2 | C1 | C2 | H5 | 59.7° | 60.0° |
H3 | C1 | C2 | H4 | 60.3° | 60.0° |
H3 | C1 | C2 | H5 | 179.7° | 60.0° |
H1 | C1 | C2 | H4 | 179.7° | 60.0° |
H1 | C1 | C2 | H5 | 60.3° | 180.0° |
H4 | C2 | C3 | H7 | 18.2° | 180.0° |
H4 | C2 | C3 | H6 | 101.1° | 60.0° |
H5 | C2 | C3 | H7 | 101.2° | 59.9° |
H5 | C2 | C3 | H6 | 139.5° | 179.9° |
H7 | C3 | C4 | H9 | 145.8° | 180.0° |
H7 | C3 | C4 | H8 | 26.4° | 60.0° |
H6 | C3 | C4 | H9 | 94.8° | 60.0° |
H6 | C3 | C4 | H8 | 145.8° | 180.0° |
H9 | C4 | C5 | H11 | 177.9° | 180.0° |
H9 | C4 | C5 | H10 | 61.5° | 60.0° |
H8 | C4 | C5 | H11 | 58.5° | 60.0° |
H8 | C4 | C5 | H10 | 179.2° | 180.0° |
H11 | C5 | C6 | H13 | 149.4° | 180.0° |
H11 | C5 | C6 | H12 | 31.1° | 60.0° |
H10 | C5 | C6 | H13 | 89.9° | 60.1° |
H10 | C5 | C6 | H12 | 151.7° | 180.0° |
H13 | C6 | C7 | H15 | 127.3° | 179.9° |
H13 | C6 | C7 | H14 | 113.0° | 60.1° |
H12 | C6 | C7 | H15 | 9.0° | 60.0° |
H12 | C6 | C7 | H14 | 128.7° | NaN° |
H15 | C7 | C8 | H17 | 70.4° | 180.0° |
H15 | C7 | C8 | H18 | 171.7° | 60.0° |
H15 | C7 | C8 | C9 | 50.6° | 60.0° |
H14 | C7 | C8 | H17 | 169.9° | 60.0° |
H14 | C7 | C8 | H18 | 52.0° | 180.0° |
H14 | C7 | C8 | C9 | 69.0° | 60.0° |
H17 | C8 | H18 | C9 | 116.5° | 119.9° |
H17 | C8 | C9 | C10 | 90.0° | 59.9° |
H17 | C8 | C9 | H16 | 90.0° | 180.0° |
H17 | C8 | C9 | H19 | 90.0° | 60.0° |
H18 | C8 | C9 | C10 | 90.0° | 60.0° |
H18 | C8 | C9 | H16 | 90.0° | 60.1° |
H18 | C8 | C9 | H19 | 90.0° | 180.0° |
C8 | C9 | C10 | H16 | 90.0° | 120.0° |
C8 | C9 | C10 | H19 | 90.0° | 120.0° |
C8 | C9 | C10 | O1 | 90.0° | 125.0° |
C8 | C9 | H16 | H19 | 90.0° | 119.9° |
C8 | C9 | C10 | H20 | 90.0° | 54.9° |
C9 | C10 | O1 | H20 | 90.0° | 179.9° |
C10 | C9 | H16 | H19 | 90.0° | 120.0° |
O1 | C10 | C9 | H16 | 90.0° | 5.0° |
O1 | C10 | C9 | H19 | 90.0° | 115.0° |
H16 | C9 | C10 | H20 | 90.0° | 174.9° |
H19 | C9 | C10 | H20 | 90.0° | 65.1° |