U6W
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
O02 | C06 | doub | 1.21Å | 1.17Å | |
C03 | C06 | sing | 1.52Å | 1.51Å | |
C03 | C05 | sing | 1.52Å | 1.45Å | |
C06 | O01 | sing | 1.34Å | 1.45Å | |
C05 | C04 | doub | 1.31Å | 1.50Å | |
O01 | C04 | sing | 1.35Å | 1.44Å | |
C04 | C07 | sing | 1.51Å | 1.52Å | |
C03 | H1 | sing | 1.09Å | 1.10Å | |
C03 | H2 | sing | 1.09Å | 1.10Å | |
C05 | H3 | sing | 1.08Å | 1.08Å | |
C07 | H4 | sing | 1.09Å | 1.10Å | |
C07 | H5 | sing | 1.09Å | 1.10Å | |
C07 | H6 | sing | 1.09Å | 1.10Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O02 | C06 | C03 | 126.0° | 127.4° |
O02 | C06 | O01 | 125.0° | 127.3° |
C06 | C03 | C05 | 106.4° | 103.0° |
C03 | C06 | O01 | 108.9° | 105.4° |
C06 | C03 | H1 | 110.2° | 110.7° |
C06 | C03 | H2 | 110.2° | 110.7° |
C03 | C05 | C04 | 108.1° | 106.2° |
C05 | C03 | H1 | 110.3° | 110.7° |
C05 | C03 | H2 | 110.2° | 110.7° |
C03 | C05 | H3 | 125.9° | 126.9° |
C06 | O01 | C04 | 108.1° | 112.3° |
C05 | C04 | O01 | 108.5° | 113.2° |
C05 | C04 | C07 | 125.5° | 123.4° |
C04 | C05 | H3 | 126.0° | 126.9° |
O01 | C04 | C07 | 126.0° | 123.4° |
C04 | C07 | H4 | 109.5° | 109.4° |
C04 | C07 | H5 | 109.5° | 109.4° |
C04 | C07 | H6 | 109.4° | 109.5° |
H1 | C03 | H2 | 109.5° | 110.7° |
H4 | C07 | H5 | 109.5° | 109.5° |
H4 | C07 | H6 | 109.5° | 109.5° |
H5 | C07 | H6 | 109.4° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O02 | C06 | C03 | O01 | 177.6° | 180.0° |
O02 | C06 | C03 | C05 | 178.9° | 180.0° |
O02 | C06 | O01 | C04 | 178.3° | 180.0° |
O02 | C06 | C03 | H1 | 59.3° | 61.6° |
O02 | C06 | C03 | H2 | 61.6° | 61.6° |
C06 | C03 | C05 | H1 | 119.5° | 118.4° |
C06 | C03 | C05 | H2 | 119.5° | 118.4° |
C06 | C03 | C05 | C04 | 1.4° | 0.0° |
C03 | C06 | O01 | C04 | 0.7° | 0.0° |
C06 | C03 | H1 | H2 | 121.4° | 123.2° |
C06 | C03 | C05 | H3 | 178.6° | 179.9° |
C05 | C03 | C06 | O01 | 1.3° | 0.0° |
C03 | C05 | C04 | H3 | 180.0° | 179.9° |
C03 | C05 | C04 | O01 | 1.0° | 0.0° |
C03 | C05 | C04 | C07 | 179.6° | 180.0° |
C05 | C03 | H1 | H2 | 121.4° | 123.2° |
C06 | O01 | C04 | C05 | 0.2° | 0.0° |
C06 | O01 | C04 | C07 | 179.5° | 180.0° |
O01 | C06 | C03 | H1 | 118.3° | 118.4° |
O01 | C06 | C03 | H2 | 120.8° | 118.4° |
C05 | C04 | O01 | C07 | 179.3° | 180.0° |
C04 | C05 | C03 | H1 | 118.1° | 118.4° |
C04 | C05 | C03 | H2 | 120.9° | 118.4° |
C05 | C04 | C07 | H4 | 179.2° | 90.0° |
C05 | C04 | C07 | H5 | 60.7° | 150.0° |
C05 | C04 | C07 | H6 | 59.2° | 30.0° |
O01 | C04 | C05 | H3 | 179.0° | 179.9° |
O01 | C04 | C07 | H4 | 0.0° | 90.0° |
O01 | C04 | C07 | H5 | 120.0° | 30.0° |
O01 | C04 | C07 | H6 | 120.0° | 150.0° |
C07 | C04 | C05 | H3 | 0.4° | 0.1° |
C04 | C07 | H4 | H5 | 120.0° | 120.0° |
C04 | C07 | H4 | H6 | 120.0° | 120.0° |
C04 | C07 | H5 | H6 | 120.0° | 120.0° |
H1 | C03 | C05 | H3 | 61.9° | 61.7° |
H2 | C03 | C05 | H3 | 59.1° | 61.5° |
H4 | C07 | H5 | H6 | 120.0° | 120.1° |