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0NX

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C5C4doub1.38Å1.39ÅAromatic
C5C6sing1.38Å1.39ÅAromatic
C4C3sing1.40Å1.40ÅAromatic
C6C1doub1.38Å1.40ÅAromatic
C3C7sing1.48Å1.48Å
C3C2doub1.40Å1.40ÅAromatic
C8C7doub1.37Å1.38ÅAromatic
C8C9sing1.41Å1.40ÅAromatic
C1C2sing1.38Å1.39ÅAromatic
C7O11sing1.34Å1.36ÅAromatic
O13C12sing1.43Å1.43Å
C12C9sing1.51Å1.50Å
C9N10doub1.30Å1.35ÅAromatic
O11N10sing1.21Å1.42ÅAromatic
O13H1sing0.97Å0.95Å
C12H2sing1.09Å1.10Å
C12H3sing1.09Å1.10Å
C8H4sing1.08Å1.08Å
C2H5sing1.08Å1.08Å
C4H6sing1.08Å1.08Å
C5H7sing1.08Å1.08Å
C6H8sing1.08Å1.08Å
C1H9sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C4C5C6118.8°120.1°
C5C4C3120.4°119.9°
C5C4H6119.8°120.1°
C4C5H7120.6°119.9°
C5C6C1120.9°120.3°
C6C5H7120.6°119.9°
C5C6H8119.6°119.8°
C4C3C7120.7°120.1°
C4C3C2121.0°119.7°
C3C4H6119.8°120.0°
C6C1C2120.6°120.1°
C1C6H8119.6°119.9°
C6C1H9119.7°120.0°
C7C3C2118.2°120.1°
C3C7C8128.9°126.9°
C3C7O11126.8°126.9°
C3C2C1118.3°119.8°
C3C2H5120.8°120.1°
C7C8C9109.2°103.9°
C8C7O11104.2°106.2°
C7C8H4125.4°128.1°
C8C9C12124.4°126.7°
C8C9N10110.1°106.6°
C9C8H4125.4°128.0°
C1C2H5120.9°120.0°
C2C1H9119.7°119.9°
C7O11N10113.0°111.5°
O13C12C9108.6°109.5°
C12O13H1109.5°114.0°
O13C12H2109.7°109.4°
O13C12H3109.7°109.4°
C12C9N10125.5°126.7°
C9C12H2109.7°109.6°
C9C12H3109.7°109.5°
C9N10O11103.4°111.9°
H2C12H3109.4°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C4C5C6H7180.0°179.9°
C5C4C3H6180.0°180.0°
C4C5C6C10.3°0.2°
C5C4C3C7178.1°180.0°
C5C4C3C20.9°0.3°
C4C5C6H8179.7°180.0°
C6C5C4C30.7°0.0°
C5C6C1H8180.0°179.8°
C5C6C1C20.1°0.2°
C6C5C4H6179.3°180.0°
C5C6C1H9179.9°180.0°
C4C3C7C2177.3°179.7°
C4C3C7C814.9°0.3°
C4C3C2C10.6°0.3°
C4C3C7O11162.3°179.9°
C4C3C2H5179.4°179.7°
C3C4C5H7179.3°180.0°
C6C1C2C30.2°0.0°
C6C1C2H9180.0°179.8°
C6C1C2H5179.8°180.0°
C1C6C5H7179.7°179.7°
C3C7C8O11177.7°179.9°
C3C7C8C9178.9°180.0°
C7C3C2C1177.9°180.0°
C3C7O11N10179.0°179.9°
C3C7C8H41.1°0.0°
C7C3C2H52.1°0.0°
C7C3C4H61.9°0.0°
C2C3C7C8167.7°180.0°
C3C2C1H5180.0°180.0°
C2C3C7O1115.0°0.2°
C2C3C4H6179.1°179.7°
C3C2C1H9179.8°179.7°
C7C8C9H4180.0°180.0°
C7C8C9C12179.6°179.9°
C7C8C9N100.8°0.2°
C8C7O11N101.2°0.0°
C9C8C7O111.2°0.2°
C8C9C12O1370.2°0.4°
C8C9C12N10179.5°179.6°
C8C9N10O110.1°0.2°
C8C9C12H249.6°119.7°
C8C9C12H3169.9°120.3°
C2C1C6H8179.9°180.0°
C7O11N10C90.7°0.1°
O11C7C8H4178.8°179.8°
O13C12C9H2119.9°120.0°
O13C12C9H3119.9°119.9°
O13C12C9N10109.2°180.0°
O13C12H2H3120.4°119.9°
C12C9N10O11179.6°179.9°
C9C12O13H1180.0°180.0°
C9C12H2H3120.4°120.0°
C12C9C8H40.4°0.1°
N10C9C12H2130.9°59.9°
N10C9C12H310.6°60.1°
N10C9C8H4179.1°179.8°
H1O13C12H260.1°59.9°
H1O13C12H360.1°60.0°
H5C2C1H90.2°0.3°
H6C4C5H70.7°0.0°
H7C5C6H80.3°0.0°
H8C6C1H90.1°0.3°

218853

PDB entries from 2024-04-24

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