FMS
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C | F1 | sing | 1.40Å | 1.28Å | |
C | F2 | sing | 1.40Å | 1.37Å | |
C | F3 | sing | 1.40Å | 1.29Å | |
C | S | sing | 1.81Å | 1.75Å | |
S | N | sing | 1.66Å | 1.62Å | |
S | O1 | doub | 1.42Å | 1.45Å | |
S | O2 | doub | 1.42Å | 1.47Å | |
N | HN1 | sing | 0.97Å | 1.02Å | |
N | HN2 | sing | 0.97Å | 1.02Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
F1 | C | F2 | 104.1° | 109.5° |
F1 | C | F3 | 114.3° | 109.5° |
F1 | C | S | 109.3° | 109.5° |
F2 | C | F3 | 113.7° | 109.5° |
F2 | C | S | 105.1° | 109.5° |
F3 | C | S | 109.8° | 109.4° |
C | S | N | 111.9° | 103.2° |
C | S | O1 | 110.0° | 111.6° |
C | S | O2 | 104.7° | 111.6° |
N | S | O1 | 105.5° | 102.9° |
N | S | O2 | 110.7° | 102.8° |
S | N | HN1 | 111.8° | 120.0° |
S | N | HN2 | 111.3° | 120.0° |
O1 | S | O2 | 114.3° | 122.1° |
HN1 | N | HN2 | 111.4° | 120.1° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
F1 | C | F2 | F3 | 125.0° | 120.0° |
F1 | C | F2 | S | 114.9° | 120.1° |
F1 | C | F3 | S | 123.3° | 120.0° |
F1 | C | S | N | 65.2° | 180.0° |
F1 | C | S | O1 | 177.9° | 70.2° |
F1 | C | S | O2 | 54.7° | 70.2° |
F2 | C | F3 | S | 117.4° | 120.0° |
F2 | C | S | N | 176.4° | 60.0° |
F2 | C | S | O1 | 66.6° | 169.8° |
F2 | C | S | O2 | 56.6° | 49.8° |
F3 | C | S | N | 60.9° | 60.0° |
F3 | C | S | O1 | 56.0° | 49.8° |
F3 | C | S | O2 | 179.2° | 169.8° |
C | S | N | O1 | 119.6° | 116.2° |
C | S | N | O2 | 116.3° | 116.2° |
C | S | O1 | O2 | 117.4° | 135.6° |
C | S | N | HN1 | 180.0° | 180.0° |
C | S | N | HN2 | 54.8° | 0.3° |
N | S | O1 | O2 | 121.8° | 114.3° |
S | N | HN1 | HN2 | 125.2° | 179.7° |
O1 | S | N | HN1 | 60.4° | 63.8° |
O1 | S | N | HN2 | 174.4° | 115.9° |
O2 | S | N | HN1 | 63.7° | 63.8° |
O2 | S | N | HN2 | 61.5° | 116.5° |