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U6N

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C1C2sing1.53Å1.49Å
C27C26doub1.38Å1.37ÅAromatic
C27C28sing1.38Å1.38ÅAromatic
C26C25sing1.39Å1.38ÅAromatic
C28C22doub1.39Å1.39ÅAromatic
C2C3sing1.51Å1.50Å
C25CL1sing1.74Å1.73Å
C25C23doub1.38Å1.39ÅAromatic
C22C23sing1.39Å1.40ÅAromatic
C22C4sing1.48Å1.47Å
C23C24sing1.51Å1.51Å
C3C4doub1.36Å1.37ÅAromatic
C3N4sing1.37Å1.42ÅAromatic
C4C5sing1.47Å1.44ÅAromatic
C18N4sing1.46Å1.46Å
C18C19sing1.47Å1.46Å
N4C17sing1.37Å1.37ÅAromatic
C19C20trip1.17Å1.24Å
O2C15doub1.21Å1.27Å
C5C17doub1.41Å1.41ÅAromatic
C5C6sing1.40Å1.41ÅAromatic
C20C21sing1.47Å1.46Å
C17N3sing1.33Å1.33ÅAromatic
C14C13doub1.38Å1.39ÅAromatic
C14C9sing1.38Å1.39ÅAromatic
N1C6sing1.38Å1.35Å
N1C7sing1.47Å1.45Å
C6N2doub1.33Å1.35ÅAromatic
C13C12sing1.38Å1.38ÅAromatic
C15C7sing1.51Å1.54Å
C15O1sing1.34Å1.25Å
C8C7sing1.53Å1.54Å
C8C9sing1.51Å1.51Å
N3C16doub1.32Å1.33ÅAromatic
C9C10doub1.38Å1.38ÅAromatic
N2C16sing1.32Å1.34ÅAromatic
C12C11doub1.38Å1.37ÅAromatic
C10C11sing1.38Å1.39ÅAromatic
C1H1sing1.09Å1.10Å
C1H2sing1.09Å1.10Å
C1H3sing1.09Å1.10Å
C2H4sing1.09Å1.10Å
C2H5sing1.09Å1.10Å
N1H6sing0.97Å1.00Å
C7H7sing1.09Å1.10Å
C8H8sing1.09Å1.10Å
C8H9sing1.09Å1.10Å
C10H10sing1.08Å1.08Å
C11H11sing1.08Å1.08Å
C12H12sing1.08Å1.08Å
C13H13sing1.08Å1.08Å
C14H14sing1.08Å1.08Å
O1H15sing0.97Å0.95Å
C16H16sing1.08Å1.08Å
C18H17sing1.09Å1.10Å
C18H18sing1.09Å1.10Å
C21H19sing1.09Å1.10Å
C21H20sing1.09Å1.10Å
C21H21sing1.09Å1.10Å
C24H22sing1.09Å1.10Å
C24H23sing1.09Å1.10Å
C24H24sing1.09Å1.10Å
C26H25sing1.08Å1.08Å
C27H26sing1.08Å1.08Å
C28H27sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C1C2C3113.9°109.5°
C2C1H1109.5°109.5°
C2C1H2109.5°109.5°
C2C1H3109.5°109.5°
C1C2H4108.4°109.5°
C1C2H5108.4°109.5°
C26C27C28120.7°120.1°
C27C26C25118.6°120.2°
C27C26H25120.7°119.9°
C26C27H26119.6°120.0°
C27C28C22120.8°119.9°
C28C27H26119.7°119.9°
C27C28H27119.6°120.0°
C26C25CL1118.2°119.9°
C26C25C23122.4°120.1°
C25C26H25120.7°119.9°
C28C22C23119.0°119.8°
C28C22C4120.7°120.1°
C22C28H27119.6°120.1°
C2C3C4127.7°125.2°
C2C3N4123.3°125.2°
C3C2H4108.4°109.4°
C3C2H5108.4°109.5°
CL1C25C23119.4°120.0°
C25C23C22118.5°119.8°
C25C23C24120.8°120.1°
C23C22C4120.2°120.1°
C22C23C24120.7°120.1°
C22C4C3127.7°126.7°
C22C4C5125.4°126.8°
C23C24H22109.5°109.5°
C23C24H23109.5°109.5°
C23C24H24109.5°109.5°
C4C3N4108.9°109.6°
C3C4C5106.9°106.5°
C3N4C18126.4°124.8°
C3N4C17108.6°110.3°
C4C5C17107.7°106.2°
C4C5C6135.4°135.1°
N4C18C19116.5°109.5°
C18N4C17124.8°124.9°
N4C18H17107.7°109.4°
N4C18H18107.7°109.5°
C18C19C20176.0°179.9°
C19C18H17107.7°109.5°
C19C18H18107.7°109.5°
N4C17C5107.8°107.4°
N4C17N3127.0°134.1°
C19C20C21177.7°180.0°
O2C15C7117.8°120.0°
O2C15O1126.0°120.0°
C17C5C6116.9°118.8°
C5C17N3125.1°118.5°
C5C6N1121.0°120.8°
C5C6N2118.7°118.4°
C20C21H19109.5°109.5°
C20C21H20109.5°109.5°
C20C21H21109.5°109.4°
C17N3C16112.4°120.7°
C13C14C9120.4°120.0°
C14C13C12120.3°120.0°
C14C13H13119.8°119.9°
C13C14H14119.8°120.0°
C14C9C8121.2°120.0°
C14C9C10118.5°120.0°
C9C14H14119.8°120.0°
C6N1C7123.2°120.0°
N1C6N2120.3°120.8°
C6N1H6105.9°120.0°
N1C7C15109.9°109.5°
N1C7C8109.9°109.5°
C7N1H6105.9°120.0°
N1C7H7110.4°109.5°
C6N2C16117.7°121.0°
C13C12C11119.6°120.0°
C13C12H12120.2°120.0°
C12C13H13119.8°120.0°
C7C15O1116.2°120.0°
C15C7C8108.4°109.4°
C15C7H7109.2°109.5°
C15O1H15109.5°117.0°
C7C8C9114.8°109.5°
C8C7H7109.1°109.5°
C7C8H8108.1°109.5°
C7C8H9108.1°109.5°
C8C9C10120.2°120.0°
C9C8H8108.1°109.5°
C9C8H9108.1°109.5°
N3C16N2129.2°122.7°
N3C16H16115.4°118.6°
C9C10C11121.1°120.0°
C9C10H10119.4°120.0°
N2C16H16115.4°118.7°
C12C11C10120.0°120.0°
C12C11H11120.0°120.0°
C11C12H12120.2°120.0°
C11C10H10119.5°120.0°
C10C11H11120.0°120.0°
H1C1H2109.5°109.5°
H1C1H3109.5°109.5°
H2C1H3109.5°109.5°
H4C2H5109.5°109.5°
H8C8H9109.5°109.5°
H17C18H18109.5°109.4°
H19C21H20109.5°109.5°
H19C21H21109.5°109.5°
H20C21H21109.5°109.5°
H22C24H23109.4°109.4°
H22C24H24109.5°109.5°
H23C24H24109.5°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C1C2C3H4120.7°120.0°
C1C2C3H5120.7°120.0°
C1C2C3C484.1°90.0°
C1C2C3N4100.2°89.7°
C2C1H1H2120.0°120.0°
C2C1H1H3120.0°120.0°
C2C1H2H3120.0°120.0°
C1C2H4H5118.0°120.0°
C26C27C28H26180.0°179.7°
C27C26C25H25180.0°180.0°
C26C27C28C221.8°0.5°
C27C26C25CL1179.3°180.0°
C27C26C25C230.3°0.0°
C26C27C28H27178.2°180.0°
C28C27C26C250.5°0.3°
C27C28C22H27180.0°179.5°
C27C28C22C232.7°0.5°
C27C28C22C4179.0°179.7°
C28C27C26H25179.5°179.7°
C26C25CL1C23179.1°180.0°
C26C25C23C221.2°0.0°
C26C25C23C24179.9°180.0°
C25C26C27H26179.5°180.0°
C28C22C23C252.4°0.2°
C28C22C23C4176.3°179.8°
C28C22C23C24179.0°179.7°
C28C22C4C3100.3°89.8°
C28C22C4C581.2°90.3°
C22C28C27H26178.2°179.8°
C2C3C4C221.3°0.1°
C2C3C4N4176.3°179.7°
C2C3C4C5177.4°180.0°
C2C3N4C186.7°0.0°
C2C3N4C17178.4°179.9°
C3C2C1H1180.0°60.0°
C3C2C1H260.0°60.0°
C3C2C1H360.0°180.0°
C3C2H4H5118.0°120.0°
CL1C25C23C22179.8°180.0°
CL1C25C23C241.1°0.0°
CL1C25C26H250.7°0.0°
C25C23C22C24178.7°179.9°
C25C23C22C4178.7°180.0°
C25C23C24H2289.3°89.9°
C25C23C24H23150.7°30.1°
C25C23C24H2430.7°150.0°
C23C25C26H25179.7°180.0°
C23C22C4C383.5°90.0°
C23C22C4C595.0°89.9°
C22C23C24H2289.3°90.0°
C22C23C24H2330.7°150.0°
C22C23C24H24150.7°30.1°
C23C22C28H27177.3°179.9°
C4C22C23C242.7°0.1°
C22C4C3C5178.7°180.0°
C22C4C3N4177.5°179.8°
C22C4C5C17178.8°180.0°
C22C4C5C61.4°0.0°
C4C22C28H271.0°0.3°
C23C24H22H23120.0°120.0°
C23C24H22H24120.0°120.1°
C23C24H23H24120.0°120.0°
C4C3N4C18176.8°179.7°
C4C3N4C172.0°0.4°
C3C4C5C170.0°0.0°
C3C4C5C6179.9°179.9°
C4C3C2H436.6°150.0°
C4C3C2H5155.3°30.0°
N4C3C4C51.2°0.2°
C3N4C18C17174.1°179.9°
C3N4C18C1978.2°90.1°
C3N4C17C51.9°0.3°
C3N4C17N3179.5°179.8°
N4C3C2H4139.2°30.3°
N4C3C2H520.5°150.3°
C3N4C18H1742.9°150.0°
C3N4C18H18160.8°30.0°
C4C5C17N41.2°0.2°
C4C5C17C6179.9°180.0°
C4C5C17N3179.8°179.9°
C4C5C6N11.2°0.1°
C4C5C6N2179.7°180.0°
N4C18C19H17121.0°120.0°
N4C18C19H18121.0°120.1°
N4C18C19C20179.2°97.0°
C18N4C17C5176.9°179.7°
C18N4C17N34.5°0.1°
N4C18H17H18116.8°120.0°
C19C18N4C17107.8°89.8°
C18C19C20C218.5°154.0°
C19C18H17H18116.8°120.0°
N4C17C5N3178.7°179.9°
N4C17C5C6178.9°179.8°
N4C17N3C16178.7°179.8°
C17N4C18H17131.2°30.1°
C17N4C18H1813.2°150.1°
C20C19C18H1759.8°143.1°
C20C19C18H1858.2°23.1°
C19C20C21H19180.0°122.9°
C19C20C21H2060.0°117.0°
C19C20C21H2160.0°3.0°
O2C15C7N127.9°0.1°
O2C15C7O1179.0°179.9°
O2C15C7C892.2°120.1°
O2C15C7H7149.1°120.0°
O2C15O1H150.0°0.0°
C17C5C6N1179.0°180.0°
C17C5C6N20.2°0.0°
C5C17N3C160.3°0.1°
C6C5C17N30.3°0.0°
C5C6N1N2179.1°180.0°
C5C6N1C7170.2°180.0°
C5C6N2C160.5°0.0°
C5C6N1H648.3°0.0°
C20C21H19H20120.0°120.0°
C20C21H19H21120.0°119.9°
C20C21H20H21120.0°119.9°
C17N3C16N20.1°0.1°
C17N3C16H16179.9°179.9°
C13C14C9H14180.0°179.4°
C14C13C12H13180.0°179.7°
C13C14C9C8179.5°179.7°
C13C14C9C100.9°0.5°
C14C13C12C110.3°0.3°
C14C13C12H12179.7°179.7°
C9C14C13C120.4°0.6°
C14C9C8C7109.9°90.3°
C14C9C8C10179.6°179.7°
C14C9C10C111.3°0.2°
C14C9C8H8129.3°149.7°
C14C9C8H910.9°29.7°
C14C9C10H10178.7°179.7°
C9C14C13H13179.6°179.7°
C6N1C7H6121.9°180.0°
C6N1C7C1568.1°85.0°
C6N1C7C8172.7°155.0°
N1C6N2C16178.6°180.0°
C6N1C7H752.4°35.0°
C7N1C6N210.6°0.0°
N1C7C15C8120.1°120.0°
N1C7C15H7121.2°120.0°
N1C7C15O1153.0°180.0°
N1C7C8H7121.1°120.0°
N1C7C8C964.4°65.0°
N1C7C8H8174.9°175.0°
N1C7C8H956.4°55.0°
C6N2C16N30.5°0.1°
N2C6N1H6132.5°180.0°
C6N2C16H16179.5°180.0°
C13C12C11H12180.0°179.9°
C13C12C11C100.7°NaN°
C13C12C11H11179.3°180.0°
C12C13C14H14179.6°180.0°
C15C7C8H7118.8°120.0°
C15C7C8C9175.5°175.0°
C15C7N1H653.8°95.0°
C15C7C8H854.7°55.0°
C15C7C8H963.7°65.0°
C7C15O1H15178.9°179.9°
O1C15C7C886.9°60.0°
O1C15C7H731.8°60.0°
C7C8C9H8120.8°120.0°
C7C8C9H9120.8°120.0°
C7C8C9C1070.5°90.0°
C8C7N1H665.4°25.0°
C7C8H8H9117.6°120.0°
C8C9C10C11179.1°180.0°
C9C8C7H756.7°55.0°
C9C8H8H9117.6°120.0°
C8C9C10H100.9°0.0°
C8C9C14H140.5°0.3°
N3C16N2H16180.0°179.9°
C9C10C11C121.2°0.0°
C9C10C11H10180.0°180.0°
C10C9C8H850.3°30.0°
C10C9C8H9168.8°150.0°
C9C10C11H11178.8°180.0°
C10C9C14H14179.1°180.0°
C12C11C10H11180.0°180.0°
C12C11C10H10178.8°180.0°
C11C12C13H13179.7°180.0°
C10C11C12H12179.3°179.9°
H1C1H2H3120.0°120.0°
H1C1C2H459.3°60.0°
H1C1C2H559.3°180.0°
H2C1C2H460.7°179.9°
H2C1C2H5179.4°60.0°
H3C1C2H4179.3°60.0°
H3C1C2H560.6°60.0°
H6N1C7H7174.2°145.0°
H7C7C8H864.0°65.0°
H7C7C8H9177.5°175.0°
H10C10C11H111.2°0.0°
H11C11C12H120.7°0.0°
H12C12C13H130.3°0.0°
H13C13C14H140.4°0.3°
H19C21H20H21120.0°120.0°
H22C24H23H24120.0°120.0°
H25C26C27H260.5°0.0°
H26C27C28H271.8°0.3°

222415

PDB entries from 2024-07-10

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