4Z4
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
F07 | C06 | sing | 1.35Å | 1.36Å | |
C06 | C05 | doub | 1.38Å | 1.40Å | Aromatic |
C06 | C08 | sing | 1.39Å | 1.40Å | Aromatic |
CL09 | C08 | sing | 1.74Å | 1.70Å | |
C05 | C04 | sing | 1.40Å | 1.40Å | Aromatic |
C08 | C10 | doub | 1.38Å | 1.41Å | Aromatic |
O01 | C02 | doub | 1.21Å | 1.36Å | |
C04 | C02 | sing | 1.48Å | 1.48Å | |
C04 | C11 | doub | 1.40Å | 1.41Å | Aromatic |
C10 | C11 | sing | 1.38Å | 1.41Å | Aromatic |
C02 | O03 | sing | 1.35Å | 1.23Å | |
C11 | CL12 | sing | 1.74Å | 1.70Å | |
C10 | H1 | sing | 1.08Å | 1.08Å | |
O03 | H2 | sing | 0.97Å | 0.95Å | |
C05 | H3 | sing | 1.08Å | 1.08Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
F07 | C06 | C05 | 119.3° | 119.9° |
F07 | C06 | C08 | 120.1° | 119.9° |
C05 | C06 | C08 | 120.5° | 120.1° |
C06 | C05 | C04 | 119.6° | 119.9° |
C06 | C05 | H3 | 120.2° | 120.1° |
C06 | C08 | CL09 | 119.1° | 119.9° |
C06 | C08 | C10 | 120.2° | 120.3° |
CL09 | C08 | C10 | 120.8° | 119.8° |
C05 | C04 | C02 | 119.8° | 120.1° |
C05 | C04 | C11 | 120.1° | 119.7° |
C04 | C05 | H3 | 120.2° | 120.1° |
C08 | C10 | C11 | 119.2° | 120.1° |
C08 | C10 | H1 | 120.4° | 119.9° |
O01 | C02 | C04 | 113.5° | 120.0° |
O01 | C02 | O03 | 118.2° | 120.0° |
C02 | C04 | C11 | 120.1° | 120.2° |
C04 | C02 | O03 | 128.2° | 120.0° |
C04 | C11 | C10 | 120.4° | 119.9° |
C04 | C11 | CL12 | 119.6° | 120.1° |
C10 | C11 | CL12 | 120.0° | 120.1° |
C11 | C10 | H1 | 120.4° | 119.9° |
C02 | O03 | H2 | 109.5° | 117.0° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
F07 | C06 | C05 | C08 | 178.4° | 179.3° |
F07 | C06 | C08 | CL09 | 1.1° | 0.2° |
F07 | C06 | C05 | C04 | 178.4° | 180.0° |
F07 | C06 | C08 | C10 | 178.1° | 179.7° |
F07 | C06 | C05 | H3 | 1.6° | 0.5° |
C05 | C06 | C08 | CL09 | 179.6° | 179.5° |
C06 | C05 | C04 | H3 | 180.0° | 179.5° |
C05 | C06 | C08 | C10 | 0.3° | 0.4° |
C06 | C05 | C04 | C02 | 179.8° | 179.5° |
C06 | C05 | C04 | C11 | 0.1° | 0.5° |
C06 | C08 | CL09 | C10 | 179.2° | 179.9° |
C08 | C06 | C05 | C04 | 0.1° | 0.7° |
C06 | C08 | C10 | C11 | 0.6° | 0.1° |
C06 | C08 | C10 | H1 | 179.4° | 179.7° |
C08 | C06 | C05 | H3 | 180.0° | 179.8° |
CL09 | C08 | C10 | C11 | 179.8° | 180.0° |
CL09 | C08 | C10 | H1 | 0.2° | 0.3° |
C05 | C04 | C02 | O01 | 37.1° | 180.0° |
C05 | C04 | C02 | C11 | 179.7° | 180.0° |
C05 | C04 | C11 | C10 | 0.3° | 0.0° |
C05 | C04 | C02 | O03 | 146.9° | 0.0° |
C05 | C04 | C11 | CL12 | 179.5° | 180.0° |
C08 | C10 | C11 | C04 | 0.6° | 0.3° |
C08 | C10 | C11 | H1 | 180.0° | 179.7° |
C08 | C10 | C11 | CL12 | 179.7° | 179.7° |
O01 | C02 | C04 | O03 | 176.0° | 179.9° |
O01 | C02 | C04 | C11 | 142.6° | 0.0° |
O01 | C02 | O03 | H2 | 0.0° | 0.0° |
C02 | C04 | C11 | C10 | 179.9° | 179.9° |
C02 | C04 | C11 | CL12 | 0.8° | 0.0° |
C04 | C02 | O03 | H2 | 175.8° | 180.0° |
C02 | C04 | C05 | H3 | 0.3° | 0.1° |
C04 | C11 | C10 | CL12 | 179.1° | 180.0° |
C11 | C04 | C02 | O03 | 33.3° | 180.0° |
C04 | C11 | C10 | H1 | 179.4° | 180.0° |
C11 | C04 | C05 | H3 | 180.0° | 180.0° |
CL12 | C11 | C10 | H1 | 0.3° | 0.0° |