EMC
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
HG | C1 | sing | 0.00Å | 2.04Å | |
C1 | C2 | sing | 0.00Å | 1.45Å | |
C1 | H11 | sing | 0.00Å | 1.11Å | |
C1 | H12 | sing | 0.00Å | 1.11Å | |
C2 | H21 | sing | 0.00Å | 1.10Å | |
C2 | H22 | sing | 0.00Å | 1.11Å | |
C2 | H23 | sing | 0.00Å | 1.12Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
HG | C1 | C2 | 111.4° | 90.0° |
HG | C1 | H11 | 111.5° | 90.0° |
HG | C1 | H12 | 111.5° | 90.0° |
C2 | C1 | H11 | 111.5° | 90.0° |
C2 | C1 | H12 | 111.5° | 90.0° |
C1 | C2 | H21 | 103.9° | 90.0° |
C1 | C2 | H22 | 111.5° | 90.0° |
C1 | C2 | H23 | 111.5° | 90.0° |
H11 | C1 | H12 | 98.9° | 90.0° |
H21 | C2 | H22 | 115.6° | 90.0° |
H21 | C2 | H23 | 115.7° | 90.0° |
H22 | C2 | H23 | 98.9° | 90.0° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
HG | C1 | C2 | H11 | 125.3° | 90.0° |
HG | C1 | C2 | H12 | 125.3° | 90.0° |
HG | C1 | H11 | H12 | 117.4° | 90.0° |
HG | C1 | C2 | H21 | 180.0° | 90.0° |
HG | C1 | C2 | H22 | 54.7° | 90.0° |
HG | C1 | C2 | H23 | 54.8° | 90.0° |
C2 | C1 | H11 | H12 | 117.4° | 90.0° |
C1 | C2 | H21 | H22 | 122.6° | 90.0° |
C1 | C2 | H21 | H23 | 122.6° | 90.0° |
C1 | C2 | H22 | H23 | 117.4° | 90.0° |
H11 | C1 | C2 | H21 | 54.8° | 90.0° |
H11 | C1 | C2 | H22 | 180.0° | 90.0° |
H11 | C1 | C2 | H23 | 70.5° | 90.0° |
H12 | C1 | C2 | H21 | 54.7° | 90.0° |
H12 | C1 | C2 | H22 | 70.6° | 90.0° |
H12 | C1 | C2 | H23 | 179.9° | 90.0° |
H21 | C2 | H22 | H23 | 124.1° | 90.0° |