JYF
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C1 | C2 | doub | 1.31Å | 1.52Å | |
C1 | CL2 | sing | 1.74Å | 1.72Å | |
C2 | CL1 | sing | 1.74Å | 1.72Å | |
C1 | H1 | sing | 1.08Å | 1.08Å | |
C2 | H2 | sing | 1.08Å | 1.08Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C2 | C1 | CL2 | 123.9° | 120.0° |
C1 | C2 | CL1 | 123.7° | 120.0° |
C2 | C1 | H1 | 118.0° | 120.0° |
C1 | C2 | H2 | 118.1° | 120.0° |
CL2 | C1 | H1 | 118.0° | 120.0° |
CL1 | C2 | H2 | 118.2° | 120.0° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C2 | C1 | CL2 | H1 | 180.0° | 179.8° |
C1 | C2 | CL1 | H2 | 180.0° | 180.0° |
CL2 | C1 | C2 | CL1 | 10.2° | 0.0° |
CL2 | C1 | C2 | H2 | 169.8° | 180.0° |
CL1 | C2 | C1 | H1 | 169.8° | 179.8° |
H1 | C1 | C2 | H2 | 10.1° | 0.2° |