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4HC

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CACA2sing1.40Å1.39ÅAromatic
CACA6doub1.37Å1.38ÅAromatic
CAHAsing1.08Å1.10Å
CA2OA2doub1.22Å1.23Å
CA2OA3sing1.34Å1.41ÅAromatic
CA4CA5doub1.40Å1.39ÅAromatic
CA4CD1sing1.39Å1.39ÅAromatic
CA4OA3sing1.35Å1.39ÅAromatic
CA5CA6sing1.47Å1.41ÅAromatic
CA5CD4sing1.40Å1.39ÅAromatic
CA6OA6sing1.35Å1.36Å
CD1CD2doub1.38Å1.39ÅAromatic
CD1HD1sing1.08Å1.10Å
CD2CD3sing1.39Å1.39ÅAromatic
CD2HD2sing1.08Å1.10Å
CD3CD4doub1.38Å1.40ÅAromatic
CD3HD3sing1.08Å1.10Å
CD4HD4sing1.08Å1.10Å
OA6HA6sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CA2CACA6119.1°119.7°
CA2CAHA120.9°120.1°
CACA2OA2118.9°119.1°
CACA2OA3120.4°121.8°
CA6CAHA120.0°120.1°
CACA6CA5120.3°118.0°
CACA6OA6118.2°121.0°
OA2CA2OA3120.7°119.1°
CA2OA3CA4120.1°121.7°
CA5CA4CD1121.2°119.4°
CA5CA4OA3118.7°119.8°
CA4CA5CA6120.3°118.9°
CA4CA5CD4118.8°120.0°
CD1CA4OA3120.0°120.7°
CA4CD1CD2119.4°120.0°
CA4CD1HD1120.4°120.0°
CA6CA5CD4120.9°121.0°
CA5CA6OA6121.5°121.0°
CA5CD4CD3120.3°119.6°
CA5CD4HD4119.7°120.1°
CA6OA6HA6118.2°106.7°
CD2CD1HD1120.2°120.0°
CD1CD2CD3119.9°120.7°
CD1CD2HD2119.9°119.6°
CD3CD2HD2120.2°119.7°
CD2CD3CD4120.0°120.3°
CD2CD3HD3119.8°119.9°
CD4CD3HD3120.2°119.8°
CD3CD4HD4120.0°120.2°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
CA2CACA6HA180.0°179.9°
CACA2OA2OA3179.7°180.0°
CACA2OA3CA410.6°0.0°
CA2CACA6CA55.6°0.2°
CA2CACA6OA6173.7°180.0°
CA6CACA2OA2177.1°180.0°
CA6CACA2OA32.7°0.0°
CACA6CA5CA46.1°0.4°
CACA6CA5OA6179.2°179.8°
CACA6CA5CD4174.3°179.7°
CACA6OA6HA6180.0°0.1°
HACACA2OA23.0°0.1°
HACACA2OA3177.3°179.9°
HACACA6CA5174.5°179.8°
HACACA6OA66.2°0.1°
OA2CA2OA3CA4169.2°180.0°
CA2OA3CA4CA59.9°0.2°
CA2OA3CA4CD1170.1°180.0°
CA5CA4CD1OA3180.0°179.8°
CA4CA5CA6CD4179.5°179.3°
CA4CA5CA6OA6173.1°179.8°
CA5CA4CD1CD22.5°0.2°
CA5CA4CD1HD1177.6°179.8°
CA4CA5CD4CD32.2°0.5°
CA4CA5CD4HD4177.8°179.8°
CD1CA4CA5CA6178.3°179.8°
CD1CA4CA5CD42.2°0.5°
CA4CD1CD2HD1180.0°180.0°
CA4CD1CD2CD37.1°0.0°
CA4CD1CD2HD2172.9°179.9°
OA3CA4CA5CA61.7°0.5°
OA3CA4CA5CD4177.8°179.8°
OA3CA4CD1CD2177.5°180.0°
OA3CA4CD1HD12.5°0.0°
CA6CA5CD4CD3178.3°179.8°
CA6CA5CD4HD41.7°0.5°
CA5CA6OA6HA60.7°179.8°
CD4CA5CA6OA66.4°0.5°
CA5CD4CD3CD22.5°0.2°
CA5CD4CD3HD4180.0°179.8°
CA5CD4CD3HD3177.5°179.8°
CD1CD2CD3HD2180.0°179.9°
CD1CD2CD3CD47.2°0.0°
CD1CD2CD3HD3172.8°179.9°
HD1CD1CD2CD3172.9°180.0°
HD1CD1CD2HD27.1°0.1°
CD2CD3CD4HD3180.0°179.9°
CD2CD3CD4HD4177.6°180.0°
HD2CD2CD3CD4172.8°179.9°
HD2CD2CD3HD37.1°0.0°
HD3CD3CD4HD42.4°0.1°

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PDB entries from 2024-07-17

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