RRA
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
N03 | C37 | sing | 1.47Å | 1.49Å | |
C37 | C38 | sing | 1.47Å | 1.75Å | |
C38 | C39 | trip | 1.17Å | 1.54Å | |
N03 | HN03 | sing | 1.01Å | 1.00Å | |
N03 | HN0A | sing | 1.01Å | 1.00Å | |
C37 | H37 | sing | 1.09Å | 1.10Å | |
C37 | H37A | sing | 1.09Å | 1.10Å | |
C39 | H39 | sing | 1.05Å | 1.06Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
N03 | C37 | C38 | 117.1° | 109.5° |
C37 | N03 | HN03 | 109.5° | 111.0° |
C37 | N03 | HN0A | 109.5° | 111.0° |
N03 | C37 | H37 | 107.0° | 109.5° |
N03 | C37 | H37A | 107.0° | 109.4° |
C37 | C38 | C39 | 180.0° | 179.9° |
C38 | C37 | H37 | 107.0° | 109.5° |
C38 | C37 | H37A | 107.0° | 109.5° |
C38 | C39 | H39 | 180.0° | 179.9° |
HN03 | N03 | HN0A | 109.5° | 111.0° |
H37 | C37 | H37A | 111.8° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
N03 | C37 | C38 | H37 | 120.0° | 120.0° |
N03 | C37 | C38 | H37A | 120.0° | 120.0° |
N03 | C37 | C38 | C39 | 41.7° | 155.3° |
C37 | N03 | HN03 | HN0A | 120.0° | 124.0° |
N03 | C37 | H37 | H37A | 116.9° | 119.9° |
C38 | C37 | N03 | HN03 | 180.0° | 56.0° |
C38 | C37 | N03 | HN0A | 60.0° | 180.0° |
C38 | C37 | H37 | H37A | 116.9° | 120.1° |
C37 | C38 | C39 | H39 | 41.7° | 172.0° |
C39 | C38 | C37 | H37 | 78.3° | 84.7° |
C39 | C38 | C37 | H37A | 161.7° | 35.3° |
HN03 | N03 | C37 | H37 | 60.0° | 176.0° |
HN03 | N03 | C37 | H37A | 60.0° | 64.0° |
HN0A | N03 | C37 | H37 | 60.0° | 60.0° |
HN0A | N03 | C37 | H37A | 180.0° | 60.0° |