2UF
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
O1 | C1 | sing | 1.43Å | 1.44Å | |
O2 | C2 | sing | 1.43Å | 1.41Å | |
C1 | C2 | sing | 1.53Å | 1.56Å | |
C2 | C3 | sing | 1.53Å | 1.54Å | |
O3 | C3 | sing | 1.43Å | 1.47Å | |
C3 | C4 | sing | 1.53Å | 1.54Å | |
O4 | C4 | sing | 1.43Å | 1.44Å | |
C4 | C5 | sing | 1.53Å | 1.55Å | |
C5 | O5 | sing | 1.43Å | 1.41Å | |
C5 | C6 | sing | 1.51Å | 1.54Å | |
O6A | C6 | doub | 1.21Å | 1.24Å | |
C6 | O6B | sing | 1.34Å | 1.24Å | |
O6B | H1 | sing | 0.97Å | 0.95Å | |
C5 | H2 | sing | 1.09Å | 1.10Å | |
O5 | H3 | sing | 0.97Å | 0.95Å | |
C4 | H4 | sing | 1.09Å | 1.10Å | |
O4 | H5 | sing | 0.97Å | 0.95Å | |
C3 | H6 | sing | 1.09Å | 1.10Å | |
O3 | H7 | sing | 0.97Å | 0.95Å | |
C2 | H8 | sing | 1.09Å | 1.10Å | |
O2 | H9 | sing | 0.97Å | 0.95Å | |
C1 | H10 | sing | 1.09Å | 1.10Å | |
C1 | H11 | sing | 1.09Å | 1.10Å | |
O1 | H12 | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O1 | C1 | C2 | 107.5° | 109.5° |
O1 | C1 | H10 | 110.0° | 109.5° |
O1 | C1 | H11 | 110.0° | 109.5° |
C1 | O1 | H12 | 109.5° | 114.0° |
O2 | C2 | C1 | 107.4° | 109.5° |
O2 | C2 | C3 | 104.8° | 109.5° |
O2 | C2 | H8 | 112.2° | 109.4° |
C2 | O2 | H9 | 109.5° | 114.0° |
C1 | C2 | C3 | 112.0° | 109.5° |
C1 | C2 | H8 | 110.0° | 109.5° |
C2 | C1 | H10 | 110.0° | 109.5° |
C2 | C1 | H11 | 110.0° | 109.5° |
C2 | C3 | O3 | 108.5° | 109.5° |
C2 | C3 | C4 | 111.4° | 109.5° |
C2 | C3 | H6 | 107.8° | 109.4° |
C3 | C2 | H8 | 110.4° | 109.5° |
O3 | C3 | C4 | 112.6° | 109.5° |
O3 | C3 | H6 | 108.7° | 109.5° |
C3 | O3 | H7 | 109.5° | 114.0° |
C3 | C4 | O4 | 110.9° | 109.5° |
C3 | C4 | C5 | 109.8° | 109.5° |
C3 | C4 | H4 | 108.3° | 109.5° |
C4 | C3 | H6 | 107.7° | 109.4° |
O4 | C4 | C5 | 109.8° | 109.5° |
O4 | C4 | H4 | 109.7° | 109.5° |
C4 | O4 | H5 | 109.5° | 114.0° |
C4 | C5 | O5 | 109.7° | 109.5° |
C4 | C5 | C6 | 110.9° | 109.5° |
C4 | C5 | H2 | 108.6° | 109.5° |
C5 | C4 | H4 | 108.3° | 109.5° |
O5 | C5 | C6 | 108.5° | 109.5° |
O5 | C5 | H2 | 110.5° | 109.4° |
C5 | O5 | H3 | 109.5° | 114.0° |
C5 | C6 | O6A | 116.6° | 120.0° |
C5 | C6 | O6B | 117.7° | 120.0° |
C6 | C5 | H2 | 108.6° | 109.5° |
O6A | C6 | O6B | 125.6° | 120.0° |
C6 | O6B | H1 | 109.5° | 117.0° |
H10 | C1 | H11 | 109.4° | 109.4° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O1 | C1 | C2 | O2 | 58.5° | 65.0° |
O1 | C1 | C2 | H10 | 119.7° | 120.1° |
O1 | C1 | C2 | H11 | 119.7° | 120.0° |
O1 | C1 | C2 | C3 | 173.0° | 175.0° |
O1 | C1 | C2 | H8 | 63.9° | 54.9° |
O1 | C1 | H10 | H11 | 120.9° | 120.0° |
O2 | C2 | C1 | C3 | 114.5° | 120.0° |
O2 | C2 | C1 | H8 | 122.4° | 119.9° |
O2 | C2 | C3 | H8 | 121.0° | 120.0° |
O2 | C2 | C3 | O3 | 70.2° | 65.0° |
O2 | C2 | C3 | C4 | 165.2° | 55.0° |
O2 | C2 | C3 | H6 | 47.3° | 174.9° |
O2 | C2 | C1 | H10 | 178.2° | 55.1° |
O2 | C2 | C1 | H11 | 61.2° | 175.0° |
C1 | C2 | C3 | H8 | 122.9° | 120.0° |
C1 | C2 | C3 | O3 | 173.6° | 55.0° |
C1 | C2 | C3 | C4 | 49.1° | 175.0° |
C1 | C2 | C3 | H6 | 68.9° | 65.1° |
C1 | C2 | O2 | H9 | 180.0° | 60.0° |
C2 | C1 | H10 | H11 | 120.9° | 120.0° |
C2 | C1 | O1 | H12 | 180.0° | 180.0° |
C2 | C3 | O3 | C4 | 123.8° | 120.0° |
C2 | C3 | O3 | H6 | 117.0° | 120.0° |
C2 | C3 | C4 | H6 | 118.0° | 119.9° |
C2 | C3 | C4 | O4 | 51.0° | 55.0° |
C2 | C3 | C4 | C5 | 172.4° | 175.0° |
C2 | C3 | C4 | H4 | 69.5° | 65.0° |
C2 | C3 | O3 | H7 | 180.0° | 60.0° |
C3 | C2 | O2 | H9 | 60.8° | 60.0° |
C3 | C2 | C1 | H10 | 67.3° | 64.9° |
C3 | C2 | C1 | H11 | 53.3° | 55.0° |
O3 | C3 | C4 | H6 | 119.8° | 120.0° |
O3 | C3 | C4 | O4 | 71.2° | 65.0° |
O3 | C3 | C4 | C5 | 50.3° | 55.0° |
O3 | C3 | C4 | H4 | 168.4° | 175.0° |
O3 | C3 | C2 | H8 | 50.7° | 175.0° |
C3 | C4 | O4 | C5 | 121.5° | 120.0° |
C3 | C4 | O4 | H4 | 119.6° | 120.0° |
C3 | C4 | C5 | H4 | 118.1° | 120.0° |
C3 | C4 | C5 | O5 | 52.5° | 60.0° |
C3 | C4 | C5 | C6 | 172.4° | 180.0° |
C3 | C4 | C5 | H2 | 68.3° | 60.0° |
C3 | C4 | O4 | H5 | 180.0° | 59.9° |
C4 | C3 | O3 | H7 | 56.2° | 60.0° |
C4 | C3 | C2 | H8 | 73.8° | 64.9° |
O4 | C4 | C5 | H4 | 119.8° | 120.0° |
O4 | C4 | C5 | O5 | 174.7° | 180.0° |
O4 | C4 | C5 | C6 | 65.5° | 60.0° |
O4 | C4 | C5 | H2 | 53.8° | 60.0° |
O4 | C4 | C3 | H6 | 169.0° | 175.0° |
C4 | C5 | O5 | C6 | 121.3° | 120.0° |
C4 | C5 | O5 | H2 | 119.8° | 120.0° |
C4 | C5 | C6 | H2 | 119.3° | 120.0° |
C4 | C5 | C6 | O6A | 88.1° | 115.0° |
C4 | C5 | C6 | O6B | 94.1° | 65.3° |
C4 | C5 | O5 | H3 | 180.0° | 60.0° |
C5 | C4 | O4 | H5 | 58.5° | 60.1° |
C5 | C4 | C3 | H6 | 69.5° | 65.0° |
O5 | C5 | C6 | H2 | 120.1° | 120.0° |
O5 | C5 | C6 | O6A | 151.4° | 5.0° |
O5 | C5 | C6 | O6B | 26.4° | 174.7° |
O5 | C5 | C4 | H4 | 65.6° | 60.0° |
C5 | C6 | O6A | O6B | 177.6° | 179.7° |
C5 | C6 | O6B | H1 | 177.6° | 179.7° |
C6 | C5 | O5 | H3 | 58.7° | 60.0° |
C6 | C5 | C4 | H4 | 54.3° | 60.0° |
O6A | C6 | O6B | H1 | 0.0° | 0.1° |
O6A | C6 | C5 | H2 | 31.2° | 125.0° |
O6B | C6 | C5 | H2 | 146.5° | 54.7° |
H2 | C5 | O5 | H3 | 60.3° | 180.0° |
H2 | C5 | C4 | H4 | 173.6° | 180.0° |
H4 | C4 | O4 | H5 | 60.4° | 180.0° |
H4 | C4 | C3 | H6 | 48.6° | 55.0° |
H6 | C3 | O3 | H7 | 63.0° | 180.0° |
H6 | C3 | C2 | H8 | 168.2° | 55.0° |
H8 | C2 | O2 | H9 | 59.0° | 180.0° |
H8 | C2 | C1 | H10 | 55.8° | 175.0° |
H8 | C2 | C1 | H11 | 176.4° | 65.1° |
H10 | C1 | O1 | H12 | 60.3° | 60.0° |
H11 | C1 | O1 | H12 | 60.3° | 60.0° |