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HJQ

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
F22C19sing1.35Å1.34Å
C19C20doub1.38Å1.41ÅAromatic
C19C18sing1.38Å1.39ÅAromatic
C20C21sing1.38Å1.40ÅAromatic
C15N06sing1.47Å1.42Å
C18C17doub1.38Å1.38ÅAromatic
C13C14sing1.53Å1.54Å
C13N04sing1.47Å1.51Å
C21C16doub1.38Å1.42ÅAromatic
C12N04sing1.47Å1.44Å
C17C16sing1.38Å1.39ÅAromatic
C14N06sing1.47Å1.51Å
N06C10sing1.47Å1.56Å
C11N04sing1.47Å1.49Å
C11C10sing1.53Å1.55Å
C16C05sing1.51Å1.54Å
C08C09sing1.53Å1.57Å
C08N02sing1.47Å1.50Å
C10C09sing1.53Å1.61Å
C03C05sing1.55Å1.56Å
C03C01sing1.54Å1.52Å
C05C07sing1.55Å1.55Å
N02C01sing1.48Å1.49Å
N02C07sing1.49Å1.50Å
C01H1sing1.09Å1.10Å
C01H2sing1.09Å1.10Å
C03H3sing1.09Å1.10Å
C03H4sing1.09Å1.10Å
C05H5sing1.09Å1.10Å
C07H6sing1.09Å1.10Å
C07H7sing1.09Å1.10Å
C08H8sing1.09Å1.10Å
C08H9sing1.09Å1.10Å
C09H10sing1.09Å1.10Å
C09H11sing1.09Å1.10Å
C10H12sing1.09Å1.10Å
C11H13sing1.09Å1.10Å
C11H14sing1.09Å1.10Å
C12H15sing1.09Å1.10Å
C12H16sing1.09Å1.10Å
C12H17sing1.09Å1.10Å
C13H18sing1.09Å1.10Å
C13H19sing1.09Å1.10Å
C14H20sing1.09Å1.10Å
C14H21sing1.09Å1.10Å
C15H22sing1.09Å1.10Å
C15H23sing1.09Å1.10Å
C15H24sing1.09Å1.10Å
C17H25sing1.08Å1.08Å
C18H26sing1.08Å1.08Å
C20H27sing1.08Å1.08Å
C21H28sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
F22C19C20120.7°120.0°
F22C19C18118.8°120.0°
C20C19C18120.5°120.0°
C19C20C21119.2°119.9°
C19C20H27120.4°120.0°
C19C18C17119.4°120.0°
C19C18H26120.3°120.0°
C20C21C16120.3°120.0°
C21C20H27120.4°120.0°
C20C21H28119.9°120.0°
C15N06C14113.0°111.0°
C15N06C10114.5°111.0°
N06C15H22109.5°109.5°
N06C15H23109.5°109.5°
N06C15H24109.5°109.5°
C18C17C16122.1°120.0°
C18C17H25118.9°120.0°
C17C18H26120.3°120.0°
C14C13N04108.7°109.4°
C13C14N06113.0°109.3°
C14C13H18109.6°109.5°
C14C13H19109.6°109.5°
C13C14H20108.6°109.5°
C13C14H21108.6°109.4°
C13N04C12113.8°111.0°
C13N04C11113.2°110.9°
N04C13H18109.7°109.5°
N04C13H19109.7°109.5°
C21C16C17118.5°120.0°
C21C16C05121.9°120.0°
C16C21H28119.9°120.0°
C12N04C11106.2°111.0°
N04C12H15109.5°109.5°
N04C12H16109.5°109.5°
N04C12H17109.4°109.5°
C17C16C05119.6°120.0°
C16C17H25118.9°120.0°
C14N06C10112.7°110.9°
N06C14H20108.6°109.5°
N06C14H21108.6°109.5°
N06C10C11113.1°109.4°
N06C10C09113.5°109.5°
N06C10H12105.2°109.5°
N04C11C10110.0°109.3°
N04C11H13109.3°109.5°
N04C11H14109.3°109.5°
C11C10C09114.0°109.5°
C11C10H12105.3°109.5°
C10C11H13109.3°109.5°
C10C11H14109.4°109.5°
C16C05C03116.5°110.7°
C16C05C07114.7°110.7°
C16C05H5106.4°110.8°
C09C08N02111.0°109.5°
C08C09C10111.8°109.5°
C09C08H8109.1°109.5°
C09C08H9109.1°109.4°
C08C09H10108.9°109.5°
C08C09H11108.8°109.5°
C08N02C01112.4°111.0°
C08N02C07111.6°111.2°
N02C08H8109.1°109.5°
N02C08H9109.1°109.4°
C10C09H10108.9°109.5°
C10C09H11108.9°109.5°
C09C10H12104.6°109.5°
C05C03C01106.6°105.1°
C03C05C07105.8°102.9°
C05C03H3110.2°110.3°
C05C03H4110.2°110.3°
C03C05H5106.3°110.7°
C03C01N02108.0°107.3°
C03C01H1109.8°109.9°
C03C01H2109.9°109.9°
C01C03H3110.2°110.3°
C01C03H4110.2°110.3°
C05C07N02107.1°103.4°
C07C05H5106.4°110.7°
C05C07H6110.1°110.7°
C05C07H7110.1°110.7°
C01N02C07107.7°105.6°
N02C01H1109.8°109.9°
N02C01H2109.8°109.9°
N02C07H6110.0°110.5°
N02C07H7110.0°110.8°
H1C01H2109.5°110.0°
H3C03H4109.5°110.4°
H6C07H7109.5°110.6°
H8C08H9109.5°109.5°
H10C09H11109.5°109.4°
H13C11H14109.5°109.5°
H15C12H16109.5°109.5°
H15C12H17109.5°109.5°
H16C12H17109.5°109.4°
H18C13H19109.5°109.5°
H20C14H21109.5°109.5°
H22C15H23109.5°109.5°
H22C15H24109.5°109.5°
H23C15H24109.4°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
F22C19C20C18179.6°179.8°
F22C19C20C21179.6°180.0°
F22C19C18C17179.9°179.8°
F22C19C18H260.1°0.2°
F22C19C20H270.4°0.2°
C19C20C21H27180.0°179.8°
C20C19C18C170.3°0.0°
C19C20C21C160.0°0.5°
C20C19C18H26179.7°180.0°
C19C20C21H28180.0°180.0°
C18C19C20C210.1°0.2°
C19C18C17H26180.0°180.0°
C19C18C17C160.5°0.0°
C19C18C17H25179.5°180.0°
C18C19C20H27179.9°180.0°
C20C21C16H28180.0°179.5°
C20C21C16C170.2°0.5°
C20C21C16C05179.6°179.8°
C15N06C14C1382.0°64.6°
C15N06C14C10131.7°123.9°
C15N06C10C1184.3°64.5°
C15N06C10C0947.5°55.4°
C15N06C10H12161.3°175.5°
C15N06C14H2038.5°55.4°
C15N06C14H21157.5°175.5°
N06C15H22H23120.0°120.0°
N06C15H22H24120.0°120.0°
N06C15H23H24120.0°120.0°
C18C17C16C210.5°0.2°
C18C17C16H25180.0°180.0°
C18C17C16C05179.8°180.0°
C14C13N04H18119.9°119.9°
C14C13N04H19119.9°120.0°
C14C13N04C12177.8°176.8°
C13C14N06H20120.5°120.0°
C13C14N06H21120.5°119.9°
C13C14N06C1049.7°59.3°
C14C13N04C1160.8°59.4°
C14C13H18H19120.3°120.1°
C13C14H20H21118.4°120.0°
C13N04C12C11125.2°123.8°
N04C13C14N0655.5°58.4°
C13N04C11C1058.3°59.3°
C13N04C11H13178.4°60.6°
C13N04C11H1461.8°179.3°
C13N04C12H15180.0°176.2°
C13N04C12H1660.0°56.2°
C13N04C12H1760.0°63.8°
N04C13H18H19120.4°120.1°
N04C13C14H20176.0°178.4°
N04C13C14H2165.0°61.5°
C21C16C17C05179.4°179.8°
C21C16C05C03124.4°58.8°
C21C16C05C070.0°54.7°
C21C16C05H5117.3°177.9°
C21C16C17H25179.5°179.8°
C16C21C20H27180.0°179.8°
C12N04C11C10176.0°176.8°
C12N04C11H1356.0°63.3°
C12N04C11H1463.9°56.9°
N04C12H15H16120.0°120.0°
N04C12H15H17120.0°120.0°
N04C12H16H17120.0°120.0°
C12N04C13H1857.9°56.8°
C12N04C13H1962.3°63.2°
C17C16C05C0356.3°121.4°
C17C16C05C07179.3°125.1°
C17C16C05H562.0°1.8°
C16C17C18H26179.5°180.0°
C17C16C21H28179.8°180.0°
C14N06C10C1146.6°59.4°
C14N06C10C09178.4°179.3°
C14N06C10H1267.8°60.6°
N06C14C13H18175.4°178.3°
N06C14C13H1964.4°61.6°
N06C14H20H21118.4°120.1°
C14N06C15H22180.0°56.0°
C14N06C15H2360.0°176.1°
C14N06C15H2460.0°64.0°
N06C10C11N0449.9°58.4°
N06C10C11C09131.6°120.0°
N06C10C11H12114.3°120.0°
N06C10C09C08141.8°65.1°
N06C10C09H12114.1°120.1°
N06C10C09H1097.8°55.0°
N06C10C09H1121.5°174.9°
N06C10C11H13170.0°61.5°
N06C10C11H1470.2°178.4°
C10N06C14H20170.2°179.3°
C10N06C14H2170.9°60.6°
C10N06C15H2249.2°179.9°
C10N06C15H2370.8°60.1°
C10N06C15H24169.3°59.8°
N04C11C10H13120.1°120.0°
N04C11C10H14120.1°119.9°
N04C11C10C09178.5°178.4°
N04C11C10H1264.4°61.6°
N04C11H13H14119.8°120.1°
C11N04C12H1554.7°60.0°
C11N04C12H16174.7°180.0°
C11N04C12H1765.3°60.0°
C11N04C13H18179.3°179.3°
C11N04C13H1959.1°60.7°
C11C10C09C0810.4°175.0°
C11C10C09H12114.5°120.0°
C11C10C09H10130.8°64.9°
C11C10C09H11109.9°55.1°
C10C11H13H14119.8°120.1°
C16C05C03C07128.8°118.3°
C16C05C03H5118.4°123.3°
C16C05C03C01130.8°140.3°
C16C05C07H5117.3°123.3°
C16C05C07N02118.5°155.7°
C16C05C03H3109.7°21.4°
C16C05C03H411.2°100.8°
C16C05C07H61.1°37.3°
C16C05C07H7121.9°85.6°
C05C16C17H250.2°0.0°
C05C16C21H280.4°0.2°
C09C08N02H8120.2°120.0°
C09C08N02H9120.2°119.9°
C08C09C10H10120.4°120.0°
C08C09C10H11120.3°120.0°
C09C08N02C01121.5°69.9°
C09C08N02C07117.3°172.8°
C09C08H8H9119.3°120.0°
C08C09H10H11118.9°120.0°
C08C09C10H12104.1°55.0°
N02C08C09C1096.1°180.0°
C08N02C01C03101.0°145.7°
C08N02C07C05103.0°159.5°
C08N02C01C07123.4°120.6°
C08N02C01H1139.2°94.8°
C08N02C01H218.8°26.3°
C08N02C07H616.6°41.0°
C08N02C07H7137.3°81.9°
N02C08H8H9119.3°120.0°
N02C08C09H1024.2°60.0°
N02C08C09H11143.5°60.0°
C10C09C08H824.1°60.0°
C10C09C08H9143.6°60.0°
C10C09H10H11118.9°120.0°
C09C10C11H1358.4°58.4°
C09C10C11H1461.4°61.7°
C05C03C01H3119.5°118.9°
C05C03C01H4119.6°118.9°
C03C05C07H5112.8°118.3°
C05C03C01N0214.8°1.1°
C03C05C07N0211.4°37.3°
C05C03C01H1104.9°120.5°
C05C03C01H2134.6°118.3°
C05C03H3H4121.3°122.2°
C03C05C07H6131.0°81.0°
C03C05C07H7108.2°156.0°
C01C03C05C072.0°22.0°
C03C01N02H1119.8°119.4°
C03C01N02H2119.8°119.4°
C03C01N02C0722.4°25.1°
C03C01H1H2120.7°121.1°
C01C03H3H4121.3°122.1°
C01C03C05H5110.8°96.4°
C05C07N02C0120.9°39.0°
C05C07N02H6119.6°118.5°
C05C07N02H7119.6°118.6°
C07C05C03H3121.5°96.9°
C07C05C03H4117.6°140.8°
C05C07H6H7121.1°123.0°
N02C01H1H2120.7°121.1°
N02C01C03H3134.4°120.1°
N02C01C03H4104.7°117.8°
C01N02C07H6140.5°79.5°
C01N02C07H798.7°157.6°
C01N02C08H8118.3°170.1°
C01N02C08H91.3°50.1°
C07N02C01H197.4°144.5°
C07N02C01H2142.2°94.3°
N02C07C05H5124.1°81.0°
N02C07H6H7121.1°123.1°
C07N02C08H82.9°52.8°
C07N02C08H9122.5°67.2°
H1C01C03H314.6°120.5°
H1C01C03H4135.5°1.6°
H2C01C03H3105.9°0.6°
H2C01C03H415.0°122.8°
H3C03C05H58.7°144.7°
H4C03C05H5129.6°22.5°
H5C05C07H6116.3°160.6°
H5C05C07H74.5°37.7°
H8C08C09H10144.4°60.0°
H8C08C09H1196.3°180.0°
H9C08C09H1096.0°179.9°
H9C08C09H1123.3°60.0°
H10C09C10H1216.3°175.1°
H11C09C10H12135.6°65.0°
H12C10C11H1355.7°178.4°
H12C10C11H14175.5°58.4°
H15C12H16H17120.0°120.0°
H18C13C14H2064.1°61.7°
H18C13C14H2154.8°58.4°
H19C13C14H2056.1°58.4°
H19C13C14H21175.1°178.4°
H22C15H23H24120.0°120.0°
H25C17C18H260.5°0.0°
H27C20C21H280.0°0.2°

222624

PDB entries from 2024-07-17

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