VW0
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C19 | O20 | sing | 1.43Å | 1.41Å | |
C19 | C18 | sing | 1.53Å | 1.48Å | |
O24 | P21 | doub | 1.48Å | 1.51Å | |
O20 | P21 | sing | 1.61Å | 1.61Å | |
O23 | P21 | sing | 1.61Å | 1.52Å | |
C18 | C02 | sing | 1.53Å | 1.56Å | |
C18 | O17 | sing | 1.43Å | 1.40Å | |
P21 | O22 | sing | 1.61Å | 1.52Å | |
O01 | C02 | sing | 1.43Å | 1.43Å | |
C02 | C03 | sing | 1.53Å | 1.57Å | |
O08 | C07 | doub | 1.21Å | 1.25Å | |
O17 | C15 | sing | 1.43Å | 1.37Å | |
O02 | C15 | sing | 1.43Å | 1.44Å | |
C05 | C07 | sing | 1.51Å | 1.54Å | |
C05 | O04 | sing | 1.43Å | 1.47Å | |
C05 | C06 | sing | 1.53Å | 1.52Å | |
C07 | O09 | sing | 1.34Å | 1.25Å | |
C15 | C10 | sing | 1.53Å | 1.51Å | |
C03 | O04 | sing | 1.43Å | 1.45Å | |
C03 | C10 | sing | 1.53Å | 1.56Å | |
C10 | N11 | sing | 1.46Å | 1.44Å | |
N11 | C12 | sing | 1.35Å | 1.34Å | |
C12 | O14 | doub | 1.21Å | 1.23Å | |
C12 | C13 | sing | 1.51Å | 1.49Å | |
C02 | H1 | sing | 1.09Å | 1.10Å | |
C03 | H2 | sing | 1.09Å | 1.10Å | |
C05 | H3 | sing | 1.09Å | 1.10Å | |
C06 | H4 | sing | 1.09Å | 1.10Å | |
C06 | H5 | sing | 1.09Å | 1.10Å | |
C06 | H6 | sing | 1.09Å | 1.10Å | |
C10 | H7 | sing | 1.09Å | 1.10Å | |
C13 | H8 | sing | 1.09Å | 1.10Å | |
C13 | H9 | sing | 1.09Å | 1.10Å | |
C13 | H10 | sing | 1.09Å | 1.10Å | |
C15 | H11 | sing | 1.09Å | 1.10Å | |
C18 | H12 | sing | 1.09Å | 1.10Å | |
C19 | H13 | sing | 1.09Å | 1.10Å | |
C19 | H14 | sing | 1.09Å | 1.10Å | |
N11 | H15 | sing | 0.97Å | 1.00Å | |
O01 | H16 | sing | 0.97Å | 0.95Å | |
O09 | H17 | sing | 0.97Å | 0.95Å | |
O22 | H18 | sing | 0.97Å | 0.95Å | |
O23 | H19 | sing | 0.97Å | 0.95Å | |
O02 | H20 | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O20 | C19 | C18 | 112.3° | 109.5° |
C19 | O20 | P21 | 118.3° | 123.0° |
O20 | C19 | H13 | 108.7° | 109.5° |
O20 | C19 | H14 | 108.8° | 109.4° |
C19 | C18 | C02 | 113.8° | 109.5° |
C19 | C18 | O17 | 105.2° | 109.5° |
C19 | C18 | H12 | 109.0° | 109.5° |
C18 | C19 | H13 | 108.8° | 109.5° |
C18 | C19 | H14 | 108.7° | 109.4° |
O24 | P21 | O20 | 106.1° | 109.5° |
O24 | P21 | O23 | 112.5° | 109.5° |
O24 | P21 | O22 | 112.1° | 109.4° |
O20 | P21 | O23 | 107.3° | 109.5° |
O20 | P21 | O22 | 106.6° | 109.4° |
O23 | P21 | O22 | 111.9° | 109.5° |
P21 | O23 | H19 | 109.5° | 114.0° |
C02 | C18 | O17 | 110.8° | 109.4° |
C18 | C02 | O01 | 107.3° | 109.6° |
C18 | C02 | C03 | 113.2° | 109.2° |
C18 | C02 | H1 | 108.7° | 109.5° |
C02 | C18 | H12 | 108.0° | 109.5° |
C18 | O17 | C15 | 111.2° | 114.1° |
O17 | C18 | H12 | 110.1° | 109.5° |
P21 | O22 | H18 | 109.5° | 114.0° |
O01 | C02 | C03 | 108.4° | 109.5° |
O01 | C02 | H1 | 110.6° | 109.5° |
C02 | O01 | H16 | 109.5° | 114.0° |
C02 | C03 | O04 | 107.3° | 109.6° |
C02 | C03 | C10 | 113.5° | 109.0° |
C03 | C02 | H1 | 108.6° | 109.5° |
C02 | C03 | H2 | 108.9° | 109.5° |
O08 | C07 | C05 | 116.7° | 120.0° |
O08 | C07 | O09 | 125.8° | 120.0° |
O17 | C15 | O02 | 110.6° | 109.5° |
O17 | C15 | C10 | 107.9° | 109.4° |
O17 | C15 | H11 | 110.1° | 109.4° |
O02 | C15 | C10 | 110.9° | 109.5° |
O02 | C15 | H11 | 109.0° | 109.5° |
C15 | O02 | H20 | 109.5° | 114.0° |
C07 | C05 | O04 | 113.2° | 109.5° |
C07 | C05 | C06 | 108.9° | 109.5° |
C05 | C07 | O09 | 117.3° | 120.0° |
C07 | C05 | H3 | 108.9° | 109.5° |
O04 | C05 | C06 | 106.7° | 109.5° |
C05 | O04 | C03 | 117.3° | 114.0° |
O04 | C05 | H3 | 109.9° | 109.5° |
C06 | C05 | H3 | 109.2° | 109.5° |
C05 | C06 | H4 | 109.5° | 109.5° |
C05 | C06 | H5 | 109.5° | 109.5° |
C05 | C06 | H6 | 109.5° | 109.4° |
C07 | O09 | H17 | 109.5° | 117.0° |
C15 | C10 | C03 | 112.0° | 109.2° |
C15 | C10 | N11 | 110.3° | 109.5° |
C15 | C10 | H7 | 108.1° | 109.5° |
C10 | C15 | H11 | 108.2° | 109.5° |
O04 | C03 | C10 | 107.6° | 109.5° |
O04 | C03 | H2 | 110.5° | 109.6° |
C03 | C10 | N11 | 110.0° | 109.5° |
C10 | C03 | H2 | 109.0° | 109.6° |
C03 | C10 | H7 | 107.4° | 109.5° |
C10 | N11 | C12 | 122.0° | 120.0° |
N11 | C10 | H7 | 108.9° | 109.5° |
C10 | N11 | H15 | 119.0° | 120.0° |
N11 | C12 | O14 | 121.9° | 120.0° |
N11 | C12 | C13 | 116.5° | 120.0° |
C12 | N11 | H15 | 119.0° | 120.0° |
O14 | C12 | C13 | 121.6° | 120.0° |
C12 | C13 | H8 | 109.5° | 109.5° |
C12 | C13 | H9 | 109.5° | 109.5° |
C12 | C13 | H10 | 109.5° | 109.5° |
H4 | C06 | H5 | 109.5° | 109.5° |
H4 | C06 | H6 | 109.5° | 109.4° |
H5 | C06 | H6 | 109.4° | 109.4° |
H8 | C13 | H9 | 109.5° | 109.6° |
H8 | C13 | H10 | 109.5° | 109.4° |
H9 | C13 | H10 | 109.5° | 109.4° |
H13 | C19 | H14 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O20 | C19 | C18 | H13 | 120.4° | 120.1° |
O20 | C19 | C18 | H14 | 120.5° | 119.9° |
C19 | O20 | P21 | O24 | 119.1° | 54.9° |
C19 | O20 | P21 | O23 | 1.3° | 174.9° |
O20 | C19 | C18 | C02 | 57.2° | 175.0° |
O20 | C19 | C18 | O17 | 64.2° | 65.0° |
C19 | O20 | P21 | O22 | 121.3° | 65.0° |
O20 | C19 | C18 | H12 | 177.8° | 55.0° |
O20 | C19 | H13 | H14 | 118.7° | 120.0° |
C18 | C19 | O20 | P21 | 100.7° | 180.0° |
C19 | C18 | C02 | O17 | 118.2° | 120.0° |
C19 | C18 | C02 | H12 | 121.2° | 120.0° |
C19 | C18 | O17 | H12 | 117.3° | 120.1° |
C19 | C18 | C02 | O01 | 126.1° | 62.4° |
C19 | C18 | C02 | C03 | 114.3° | 177.6° |
C19 | C18 | O17 | C15 | 179.2° | 178.8° |
C19 | C18 | C02 | H1 | 6.5° | 57.7° |
C18 | C19 | H13 | H14 | 118.7° | 120.0° |
O24 | P21 | O20 | O23 | 120.4° | 120.0° |
O24 | P21 | O20 | O22 | 119.6° | 119.9° |
O24 | P21 | O23 | O22 | 127.1° | 120.0° |
O24 | P21 | O22 | H18 | 0.0° | 180.0° |
O24 | P21 | O23 | H19 | 0.0° | 60.0° |
O20 | P21 | O23 | O22 | 116.6° | 120.0° |
P21 | O20 | C19 | H13 | 138.9° | 60.0° |
P21 | O20 | C19 | H14 | 19.7° | 60.1° |
O20 | P21 | O22 | H18 | 115.7° | 60.0° |
O20 | P21 | O23 | H19 | 116.3° | 180.0° |
O23 | P21 | O22 | H18 | 127.4° | 60.0° |
C02 | C18 | O17 | H12 | 119.4° | 119.9° |
C18 | C02 | O01 | C03 | 122.6° | 119.7° |
C18 | C02 | O01 | H1 | 118.4° | 120.2° |
C18 | C02 | C03 | H1 | 120.9° | 119.9° |
C02 | C18 | O17 | C15 | 55.9° | 61.1° |
C18 | C02 | C03 | O04 | 82.0° | 176.8° |
C18 | C02 | C03 | C10 | 36.8° | 57.0° |
C18 | C02 | C03 | H2 | 158.4° | 63.0° |
C02 | C18 | C19 | H13 | 63.2° | 54.9° |
C02 | C18 | C19 | H14 | 177.6° | 65.1° |
C18 | C02 | O01 | H16 | 180.0° | 60.3° |
O17 | C18 | C02 | O01 | 115.6° | 177.5° |
O17 | C18 | C02 | C03 | 3.9° | 57.6° |
C18 | O17 | C15 | O02 | 40.1° | 58.8° |
C18 | O17 | C15 | C10 | 81.4° | 61.2° |
O17 | C18 | C02 | H1 | 124.8° | 62.3° |
C18 | O17 | C15 | H11 | 160.7° | 178.8° |
O17 | C18 | C19 | H13 | 175.4° | 174.9° |
O17 | C18 | C19 | H14 | 56.2° | 54.9° |
O22 | P21 | O23 | H19 | 127.2° | 60.0° |
O01 | C02 | C03 | H1 | 120.2° | 120.1° |
O01 | C02 | C03 | O04 | 159.1° | 63.2° |
O01 | C02 | C03 | C10 | 82.1° | 177.0° |
O01 | C02 | C03 | H2 | 39.5° | 57.0° |
O01 | C02 | C18 | H12 | 5.0° | 57.6° |
C02 | C03 | O04 | C05 | 72.6° | 138.0° |
C02 | C03 | C10 | C15 | 15.2° | 57.0° |
C02 | C03 | O04 | C10 | 122.5° | 119.5° |
C02 | C03 | O04 | H2 | 118.6° | 120.2° |
C02 | C03 | C10 | H2 | 121.6° | 119.9° |
C02 | C03 | C10 | N11 | 107.9° | 176.9° |
C02 | C03 | C10 | H7 | 133.7° | 63.0° |
C03 | C02 | C18 | H12 | 124.6° | 62.4° |
C03 | C02 | O01 | H16 | 57.4° | 180.0° |
O08 | C07 | C05 | O09 | 174.6° | 179.9° |
O08 | C07 | C05 | O04 | 126.0° | 4.9° |
O08 | C07 | C05 | C06 | 115.5° | 115.1° |
O08 | C07 | C05 | H3 | 3.5° | 124.9° |
O08 | C07 | O09 | H17 | 0.0° | 0.1° |
O17 | C15 | O02 | C10 | 119.7° | 120.0° |
O17 | C15 | O02 | H11 | 121.2° | 120.0° |
O17 | C15 | C10 | H11 | 119.1° | 119.9° |
O17 | C15 | C10 | C03 | 39.8° | 57.6° |
O17 | C15 | C10 | N11 | 162.7° | 177.6° |
O17 | C15 | C10 | H7 | 78.4° | 62.3° |
C15 | O17 | C18 | H12 | 63.4° | 58.8° |
O17 | C15 | O02 | H20 | 180.0° | 60.1° |
O02 | C15 | C10 | H11 | 119.6° | 120.1° |
O02 | C15 | C10 | C03 | 81.5° | 62.4° |
O02 | C15 | C10 | N11 | 41.4° | 57.5° |
O02 | C15 | C10 | H7 | 160.3° | 177.7° |
C07 | C05 | O04 | C06 | 119.7° | 120.0° |
C07 | C05 | O04 | H3 | 122.0° | 120.0° |
C07 | C05 | C06 | H3 | 118.8° | 120.0° |
C07 | C05 | O04 | C03 | 27.1° | 151.3° |
C07 | C05 | C06 | H4 | 180.0° | 175.2° |
C07 | C05 | C06 | H5 | 60.0° | 55.1° |
C07 | C05 | C06 | H6 | 60.0° | 64.8° |
C05 | C07 | O09 | H17 | 174.0° | 180.0° |
O04 | C05 | C06 | H3 | 118.7° | 120.0° |
O04 | C05 | C07 | O09 | 59.4° | 175.0° |
C05 | O04 | C03 | C10 | 164.9° | 102.5° |
C05 | O04 | C03 | H2 | 46.0° | 17.8° |
O04 | C05 | C06 | H4 | 57.5° | 64.8° |
O04 | C05 | C06 | H5 | 177.6° | 175.1° |
O04 | C05 | C06 | H6 | 62.5° | 55.2° |
C06 | C05 | C07 | O09 | 59.0° | 65.0° |
C06 | C05 | O04 | C03 | 146.8° | 88.7° |
C05 | C06 | H4 | H5 | 120.0° | 120.1° |
C05 | C06 | H4 | H6 | 120.0° | 120.0° |
C05 | C06 | H5 | H6 | 120.0° | 119.9° |
O09 | C07 | C05 | H3 | 178.0° | 55.0° |
C15 | C10 | C03 | O04 | 103.3° | 176.8° |
C15 | C10 | C03 | N11 | 123.1° | 119.9° |
C15 | C10 | C03 | H7 | 118.6° | 119.9° |
C15 | C10 | N11 | H7 | 118.5° | 120.2° |
C15 | C10 | N11 | C12 | 97.1° | 88.2° |
C15 | C10 | C03 | H2 | 136.8° | 62.9° |
C15 | C10 | N11 | H15 | 82.9° | 91.8° |
C10 | C15 | O02 | H20 | 60.3° | 180.0° |
O04 | C03 | C10 | H2 | 119.9° | 120.2° |
O04 | C03 | C10 | N11 | 133.6° | 63.2° |
O04 | C03 | C02 | H1 | 38.9° | 56.9° |
C03 | O04 | C05 | H3 | 94.9° | 31.3° |
O04 | C03 | C10 | H7 | 15.2° | 56.9° |
C03 | C10 | N11 | H7 | 117.5° | 120.2° |
C03 | C10 | N11 | C12 | 138.9° | 152.2° |
C10 | C03 | C02 | H1 | 157.6° | 62.9° |
C03 | C10 | C15 | H11 | 158.9° | 177.6° |
C03 | C10 | N11 | H15 | 41.1° | 27.9° |
C10 | N11 | C12 | H15 | 180.0° | 180.0° |
C10 | N11 | C12 | O14 | 1.4° | 0.0° |
C10 | N11 | C12 | C13 | 179.4° | 180.0° |
N11 | C10 | C03 | H2 | 13.7° | 57.0° |
N11 | C10 | C15 | H11 | 78.2° | 62.5° |
N11 | C12 | O14 | C13 | 179.2° | 180.0° |
C12 | N11 | C10 | H7 | 21.5° | 32.0° |
N11 | C12 | C13 | H8 | 179.2° | 90.1° |
N11 | C12 | C13 | H9 | 59.2° | 30.1° |
N11 | C12 | C13 | H10 | 60.8° | 150.0° |
O14 | C12 | C13 | H8 | 0.0° | 90.0° |
O14 | C12 | C13 | H9 | 120.0° | 149.9° |
O14 | C12 | C13 | H10 | 120.0° | 30.0° |
O14 | C12 | N11 | H15 | 178.6° | 180.0° |
C12 | C13 | H8 | H9 | 120.0° | 120.1° |
C12 | C13 | H8 | H10 | 120.0° | 120.0° |
C12 | C13 | H9 | H10 | 120.0° | 120.0° |
C13 | C12 | N11 | H15 | 0.6° | 0.0° |
H1 | C02 | C03 | H2 | 80.8° | 177.1° |
H1 | C02 | C18 | H12 | 114.6° | 177.7° |
H1 | C02 | O01 | H16 | 61.6° | 59.9° |
H2 | C03 | C10 | H7 | 104.7° | 177.1° |
H3 | C05 | C06 | H4 | 61.2° | 55.2° |
H3 | C05 | C06 | H5 | 58.8° | 64.9° |
H3 | C05 | C06 | H6 | 178.8° | 175.2° |
H4 | C06 | H5 | H6 | 120.0° | 120.0° |
H7 | C10 | C15 | H11 | 40.7° | 57.6° |
H7 | C10 | N11 | H15 | 158.6° | 148.0° |
H8 | C13 | H9 | H10 | 120.0° | 120.0° |
H11 | C15 | O02 | H20 | 58.8° | 59.9° |
H12 | C18 | C19 | H13 | 57.3° | 65.0° |
H12 | C18 | C19 | H14 | 61.8° | 175.0° |