GH0
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
O4 | S | doub | 1.42Å | 1.46Å | |
O3 | S | doub | 1.42Å | 1.47Å | |
S | O2 | sing | 1.52Å | 1.47Å | |
S | O1 | sing | 1.52Å | 1.66Å | |
O1 | C2 | sing | 1.43Å | 1.40Å | |
C2 | C1 | sing | 1.53Å | 1.53Å | |
C1 | N | sing | 1.47Å | 1.46Å | |
N | H5 | sing | 1.01Å | 1.00Å | |
N | H6 | sing | 1.01Å | 1.00Å | |
C1 | H1 | sing | 1.09Å | 1.10Å | |
C1 | H2 | sing | 1.09Å | 1.10Å | |
C2 | H3 | sing | 1.09Å | 1.10Å | |
C2 | H4 | sing | 1.09Å | 1.10Å | |
O2 | H7 | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O4 | S | O3 | 105.0° | 123.2° |
O4 | S | O2 | 103.6° | 106.4° |
O4 | S | O1 | 113.9° | 106.4° |
O3 | S | O2 | 103.6° | 106.4° |
O3 | S | O1 | 116.0° | 106.4° |
O2 | S | O1 | 113.4° | 107.2° |
S | O2 | H7 | 109.5° | 114.0° |
S | O1 | C2 | 120.4° | 114.0° |
O1 | C2 | C1 | 109.6° | 109.5° |
O1 | C2 | H3 | 109.4° | 109.4° |
O1 | C2 | H4 | 109.5° | 109.4° |
C2 | C1 | N | 111.4° | 109.5° |
C2 | C1 | H1 | 109.0° | 109.5° |
C2 | C1 | H2 | 109.0° | 109.5° |
C1 | C2 | H3 | 109.4° | 109.5° |
C1 | C2 | H4 | 109.4° | 109.5° |
C1 | N | H5 | 109.5° | 111.1° |
C1 | N | H6 | 109.4° | 111.0° |
N | C1 | H1 | 109.0° | 109.4° |
N | C1 | H2 | 109.0° | 109.5° |
H5 | N | H6 | 109.5° | 111.0° |
H1 | C1 | H2 | 109.5° | 109.5° |
H3 | C2 | H4 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O4 | S | O3 | O2 | 108.4° | 122.9° |
O4 | S | O3 | O1 | 126.7° | 122.9° |
O4 | S | O2 | O1 | 124.0° | 113.6° |
O4 | S | O1 | C2 | 93.0° | 38.6° |
O4 | S | O2 | H7 | 0.0° | 66.5° |
O3 | S | O2 | O1 | 126.6° | 113.5° |
O3 | S | O1 | C2 | 29.1° | 171.5° |
O3 | S | O2 | H7 | 109.4° | 66.4° |
O2 | S | O1 | C2 | 148.9° | 75.0° |
S | O1 | C2 | C1 | 171.3° | 180.0° |
S | O1 | C2 | H3 | 68.7° | 60.0° |
S | O1 | C2 | H4 | 51.3° | 60.0° |
O1 | S | O2 | H7 | 124.0° | 180.0° |
O1 | C2 | C1 | H3 | 120.0° | 120.0° |
O1 | C2 | C1 | H4 | 120.0° | 120.0° |
O1 | C2 | C1 | N | 81.2° | 65.0° |
O1 | C2 | C1 | H1 | 158.5° | 55.0° |
O1 | C2 | C1 | H2 | 39.1° | 175.0° |
O1 | C2 | H3 | H4 | 120.0° | 119.9° |
C2 | C1 | N | H1 | 120.3° | 120.0° |
C2 | C1 | N | H2 | 120.3° | 120.0° |
C2 | C1 | N | H5 | 180.0° | 180.0° |
C2 | C1 | N | H6 | 60.0° | 56.0° |
C2 | C1 | H1 | H2 | 119.1° | 120.0° |
C1 | C2 | H3 | H4 | 119.9° | 120.1° |
C1 | N | H5 | H6 | 120.0° | 124.0° |
N | C1 | H1 | H2 | 119.1° | 120.0° |
N | C1 | C2 | H3 | 38.8° | 175.0° |
N | C1 | C2 | H4 | 158.8° | 55.0° |
H5 | N | C1 | H1 | 59.7° | 60.0° |
H5 | N | C1 | H2 | 59.7° | 60.0° |
H6 | N | C1 | H1 | 179.7° | 64.0° |
H6 | N | C1 | H2 | 60.3° | 176.0° |
H1 | C1 | C2 | H3 | 81.4° | 65.0° |
H1 | C1 | C2 | H4 | 38.5° | 175.0° |
H2 | C1 | C2 | H3 | 159.1° | 55.0° |
H2 | C1 | C2 | H4 | 81.0° | 65.0° |