I7Z
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
N10 | C04 | sing | 1.39Å | 1.41Å | |
C04 | C05 | doub | 1.39Å | 1.36Å | Aromatic |
C04 | C03 | sing | 1.40Å | 1.34Å | Aromatic |
C05 | C06 | sing | 1.38Å | 1.36Å | Aromatic |
N01 | C02 | trip | 1.14Å | 1.06Å | |
C02 | C03 | sing | 1.43Å | 1.51Å | |
C03 | C09 | doub | 1.40Å | 1.36Å | Aromatic |
C06 | CL1 | sing | 1.74Å | 1.68Å | |
C06 | C08 | doub | 1.39Å | 1.36Å | Aromatic |
C09 | C08 | sing | 1.38Å | 1.34Å | Aromatic |
C05 | H1 | sing | 1.08Å | 1.08Å | |
C08 | H2 | sing | 1.08Å | 1.08Å | |
C09 | H3 | sing | 1.08Å | 1.08Å | |
N10 | H4 | sing | 0.97Å | 1.00Å | |
N10 | H5 | sing | 0.97Å | 1.00Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
N10 | C04 | C05 | 121.1° | 120.2° |
N10 | C04 | C03 | 119.4° | 120.2° |
C04 | N10 | H4 | 109.5° | 120.0° |
C04 | N10 | H5 | 109.5° | 120.0° |
C05 | C04 | C03 | 119.5° | 119.7° |
C04 | C05 | C06 | 117.7° | 120.0° |
C04 | C05 | H1 | 121.1° | 120.0° |
C04 | C03 | C02 | 115.6° | 120.2° |
C04 | C03 | C09 | 120.7° | 119.6° |
C05 | C06 | CL1 | 116.8° | 119.8° |
C05 | C06 | C08 | 124.5° | 120.4° |
C06 | C05 | H1 | 121.1° | 120.0° |
N01 | C02 | C03 | 176.3° | 180.0° |
C02 | C03 | C09 | 123.7° | 120.2° |
C03 | C09 | C08 | 122.3° | 119.9° |
C03 | C09 | H3 | 118.9° | 120.1° |
CL1 | C06 | C08 | 118.7° | 119.8° |
C06 | C08 | C09 | 115.3° | 120.3° |
C06 | C08 | H2 | 122.4° | 119.8° |
C09 | C08 | H2 | 122.3° | 119.8° |
C08 | C09 | H3 | 118.9° | 120.0° |
H4 | N10 | H5 | 109.5° | 120.0° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
N10 | C04 | C05 | C03 | 179.5° | 180.0° |
N10 | C04 | C05 | C06 | 178.1° | 180.0° |
N10 | C04 | C03 | C02 | 2.6° | 0.0° |
N10 | C04 | C03 | C09 | 178.6° | 179.8° |
N10 | C04 | C05 | H1 | 1.9° | 0.0° |
C04 | N10 | H4 | H5 | 120.0° | 180.0° |
C04 | C05 | C06 | H1 | 180.0° | 180.0° |
C05 | C04 | C03 | C02 | 178.0° | 180.0° |
C05 | C04 | C03 | C09 | 0.8° | 0.2° |
C04 | C05 | C06 | CL1 | 179.5° | 180.0° |
C04 | C05 | C06 | C08 | 1.5° | 0.0° |
C05 | C04 | N10 | H4 | 180.0° | 0.0° |
C05 | C04 | N10 | H5 | 60.0° | 180.0° |
C03 | C04 | C05 | C06 | 1.3° | 0.0° |
C04 | C03 | C02 | N01 | 9.7° | 180.0° |
C04 | C03 | C02 | C09 | 178.7° | 179.8° |
C04 | C03 | C09 | C08 | 0.4° | 0.4° |
C03 | C04 | C05 | H1 | 178.6° | 180.0° |
C04 | C03 | C09 | H3 | 179.6° | 179.7° |
C03 | C04 | N10 | H4 | 0.5° | 180.0° |
C03 | C04 | N10 | H5 | 119.5° | 0.0° |
C05 | C06 | CL1 | C08 | 179.0° | 179.9° |
C05 | C06 | C08 | C09 | 1.1° | 0.1° |
C05 | C06 | C08 | H2 | 178.9° | 180.0° |
N01 | C02 | C03 | C09 | 169.0° | 0.2° |
C02 | C03 | C09 | C08 | 178.3° | 179.8° |
C02 | C03 | C09 | H3 | 1.7° | 0.1° |
C03 | C09 | C08 | C06 | 0.5° | 0.4° |
C03 | C09 | C08 | H3 | 180.0° | 179.9° |
C03 | C09 | C08 | H2 | 179.5° | 179.7° |
CL1 | C06 | C08 | C09 | 180.0° | 179.8° |
CL1 | C06 | C05 | H1 | 0.5° | 0.0° |
CL1 | C06 | C08 | H2 | 0.0° | 0.1° |
C06 | C08 | C09 | H2 | 180.0° | 179.9° |
C08 | C06 | C05 | H1 | 178.5° | 179.9° |
C06 | C08 | C09 | H3 | 179.5° | 179.8° |
H2 | C08 | C09 | H3 | 0.5° | 0.1° |