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A1JHG

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CLC12sing1.74Å1.79Å
C12C11doub1.38Å1.40ÅAromatic
C12C9sing1.40Å1.48ÅAromatic
C11N5sing1.33Å1.34ÅAromatic
N5C10doub1.32Å1.39ÅAromatic
C10N6sing1.38Å1.43Å
C10N4sing1.33Å1.35ÅAromatic
N6C18sing1.48Å1.47Å
N6C13sing1.44Å1.48Å
C18C17sing1.46Å1.52Å
C17N7sing1.48Å1.47Å
N7C16sing1.47Å1.47Å
N7C15sing1.44Å1.47Å
C15C14sing1.54Å1.52Å
C14C13sing1.54Å1.53Å
N4C9doub1.33Å1.35ÅAromatic
C9N3sing1.39Å1.39Å
N3C7sing1.47Å1.47Å
N3C8sing1.47Å1.42Å
C7C6sing1.53Å1.50Å
C8C6sing1.53Å1.57Å
C6C5sing1.51Å1.55Å
C5Odoub1.21Å1.22Å
C5N2sing1.35Å1.30Å
N2C4sing1.46Å1.47Å
C4C3sing1.51Å1.51Å
C3C1sing1.40Å1.42ÅAromatic
C3C19doub1.35Å1.42ÅAromatic
C1C2sing1.51Å1.50Å
C1N1doub1.31Å1.33ÅAromatic
N1Nsing1.40Å1.31ÅAromatic
C19C20sing1.51Å1.52Å
C19Nsing1.35Å1.34ÅAromatic
NCsing1.46Å1.49Å
C11H14sing1.08Å1.08Å
C13H15sing1.09Å1.10Å
C13H16sing1.09Å1.10Å
C14H17sing1.09Å1.10Å
C14H18sing1.09Å1.10Å
C15H19sing1.09Å1.10Å
C15H20sing1.09Å1.10Å
C17H24sing1.09Å1.10Å
C17H25sing1.09Å1.10Å
C18H26sing1.09Å1.10Å
C18H27sing1.09Å1.10Å
C20H28sing1.09Å1.10Å
C20H29sing1.09Å1.10Å
C20H30sing1.09Å1.10Å
C16H21sing1.09Å1.10Å
C16H22sing1.09Å1.10Å
C16H23sing1.09Å1.10Å
C7H10sing1.09Å1.10Å
C7H11sing1.09Å1.10Å
C8H12sing1.09Å1.10Å
C8H13sing1.09Å1.10Å
C6H9sing1.09Å1.10Å
N2H8sing0.97Å1.00Å
C4H6sing1.09Å1.10Å
C4H7sing1.09Å1.10Å
C2H3sing1.09Å1.10Å
C2H4sing1.09Å1.10Å
C2H5sing1.09Å1.10Å
CHsing1.09Å1.10Å
CH1sing1.09Å1.10Å
CH2sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CLC12C11124.4°120.8°
CLC12C9119.3°120.8°
C11C12C9116.2°118.4°
C12C11N5122.2°119.3°
C12C11H14118.9°120.4°
C12C9N4117.7°119.1°
C12C9N3126.8°120.5°
C11N5C10121.1°121.0°
N5C11H14118.9°120.3°
N5C10N6126.1°119.2°
N5C10N4118.5°121.6°
N6C10N4115.3°119.2°
C10N6C18120.2°111.0°
C10N6C13119.8°111.0°
C10N4C9124.2°120.6°
C18N6C13119.8°109.9°
N6C18C1797.9°112.2°
N6C18H26112.3°108.8°
N6C18H27112.3°108.8°
N6C13C14111.6°112.6°
N6C13H15108.9°108.9°
N6C13H16108.9°108.8°
C18C17N7112.6°112.1°
C18C17H24108.7°108.9°
C18C17H25108.7°108.9°
C17C18H26112.3°108.9°
C17C18H27112.3°109.0°
C17N7C16105.9°111.0°
C17N7C15118.6°109.9°
N7C17H24108.7°109.0°
N7C17H25108.7°109.0°
C16N7C15104.5°111.0°
N7C16H21109.5°109.4°
N7C16H22109.4°109.5°
N7C16H23109.5°109.5°
N7C15C14108.2°112.6°
N7C15H19109.8°108.8°
N7C15H20109.8°108.8°
C15C14C13109.7°111.7°
C15C14H17109.4°109.0°
C15C14H18109.4°108.9°
C14C15H19109.8°108.8°
C14C15H20109.8°108.9°
C14C13H15108.9°108.9°
C14C13H16108.9°108.9°
C13C14H17109.4°109.1°
C13C14H18109.4°109.1°
N4C9N3115.5°120.4°
C9N3C7131.9°111.0°
C9N3C8126.5°111.0°
C7N3C8101.4°87.8°
N3C7C682.9°87.9°
N3C7H10115.6°113.5°
N3C7H11115.6°113.5°
N3C8C682.1°87.9°
N3C8H12115.8°113.5°
N3C8H13115.8°113.5°
C7C6C893.5°83.6°
C7C6C5113.7°114.2°
C6C7H10115.6°113.5°
C6C7H11115.6°113.5°
C7C6H9110.0°114.2°
C8C6C5120.2°114.1°
C6C8H12115.8°113.5°
C6C8H13115.8°113.5°
C8C6H9109.1°114.2°
C6C5O122.2°120.0°
C6C5N2115.3°120.0°
C5C6H9109.3°113.3°
OC5N2122.6°120.0°
C5N2C4119.4°120.0°
C5N2H8120.3°120.0°
N2C4C3106.9°109.4°
C4N2H8120.3°120.0°
N2C4H6110.1°109.5°
N2C4H7110.1°109.5°
C4C3C1123.9°126.1°
C4C3C19129.0°126.0°
C3C4H6110.1°109.5°
C3C4H7110.1°109.5°
C1C3C19106.8°107.9°
C3C1C2130.8°125.9°
C3C1N1107.4°108.2°
C3C19C20130.4°126.1°
C3C19N103.1°107.8°
C2C1N1121.7°125.9°
C1C2H3109.5°109.5°
C1C2H4109.5°109.5°
C1C2H5109.4°109.4°
C1N1N107.4°108.2°
N1NC19114.9°107.9°
N1NC118.1°126.0°
C20C19N126.2°126.1°
C19C20H28109.5°109.4°
C19C20H29109.5°109.5°
C19C20H30109.5°109.4°
C19NC127.0°126.1°
NCH109.5°109.5°
NCH1109.5°109.5°
NCH2109.5°109.4°
H15C13H16109.5°108.8°
H17C14H18109.5°109.0°
H19C15H20109.5°108.8°
H24C17H25109.5°108.9°
H26C18H27109.5°109.0°
H28C20H29109.5°109.5°
H28C20H30109.5°109.4°
H29C20H30109.5°109.5°
H21C16H22109.5°109.5°
H21C16H23109.4°109.5°
H22C16H23109.5°109.5°
H10C7H11109.5°112.8°
H12C8H13109.5°112.7°
H6C4H7109.5°109.5°
H3C2H4109.4°109.5°
H3C2H5109.5°109.5°
H4C2H5109.5°109.4°
HCH1109.5°109.5°
HCH2109.5°109.4°
H1CH2109.4°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
CLC12C11C9179.0°179.9°
CLC12C11N5178.7°179.9°
CLC12C9N4179.0°179.5°
CLC12C9N31.0°0.1°
CLC12C11H141.3°0.2°
C12C11N5H14180.0°179.8°
C12C11N5C100.5°0.2°
C11C12C9N41.9°0.6°
C11C12C9N3179.9°180.0°
C9C12C11N52.2°0.1°
C12C9N4C100.1°0.9°
C12C9N4N3178.3°179.4°
C12C9N3C722.8°180.0°
C12C9N3C8162.6°84.0°
C9C12C11H14177.8°179.7°
C11N5C10N6176.0°180.0°
C11N5C10N41.6°0.0°
N5C10N6N4177.6°180.0°
N5C10N6C1817.3°124.0°
N5C10N6C13167.5°1.4°
N5C10N4C91.9°0.6°
C10N5C11H14179.5°180.0°
C10N6C18C13175.2°123.2°
C10N6C18C1791.6°156.3°
C10N6C13C14154.7°142.5°
N6C10N4C9175.9°179.4°
C10N6C13H1534.4°96.7°
C10N6C13H1685.0°21.7°
C10N6C18H26150.3°35.7°
C10N6C18H2726.4°83.0°
N4C10N6C18160.3°56.0°
N4C10N6C1314.9°178.6°
C10N4C9N3178.1°179.7°
N6C18C17H26118.1°120.6°
N6C18C17H27118.1°120.6°
N6C18C17N784.0°60.8°
C18N6C13C1430.0°94.3°
C18N6C13H15150.3°26.5°
C18N6C13H1690.3°145.0°
N6C18C17H24155.6°178.6°
N6C18C17H2536.5°59.9°
N6C18H26H27125.4°118.6°
C13N6C18C1793.2°80.5°
N6C13C14C1558.5°41.1°
N6C13C14H15120.3°120.8°
N6C13C14H16120.3°120.7°
N6C13H15H16119.0°118.5°
N6C13C14H1761.5°79.5°
N6C13C14H18178.5°161.5°
C13N6C18H2624.9°158.9°
C13N6C18H27148.8°40.3°
C18C17N7H24120.5°120.6°
C18C17N7H25120.5°120.6°
C18C17N7C16178.0°156.4°
C18C17N7C1565.1°80.4°
C18C17H24H25118.6°118.7°
C17C18H26H27125.4°118.8°
C17N7C16C15126.0°122.6°
C17N7C15C1468.1°94.3°
C17N7C15H19172.2°26.5°
C17N7C15H2051.8°144.9°
N7C17H24H25118.6°118.8°
N7C17C18H2634.1°178.6°
N7C17C18H27157.9°59.9°
C17N7C16H21180.0°63.9°
C17N7C16H2260.0°176.1°
C17N7C16H2360.0°56.0°
C16N7C15C14174.3°142.5°
C16N7C15H1954.5°96.8°
C16N7C15H2065.9°21.7°
C16N7C17H2457.6°35.8°
C16N7C17H2561.5°82.9°
N7C16H21H22120.0°120.0°
N7C16H21H23120.0°120.0°
N7C16H22H23120.0°120.0°
N7C15C14H19119.8°120.8°
N7C15C14H20119.8°120.8°
N7C15C14C1389.2°41.0°
N7C15C14H1730.8°161.6°
N7C15C14H18150.7°79.5°
N7C15H19H20120.6°118.4°
C15N7C17H24174.4°159.0°
C15N7C17H2555.4°40.3°
C15N7C16H2154.0°58.6°
C15N7C16H22174.0°61.3°
C15N7C16H2366.0°178.6°
C15C14C13H17120.0°120.6°
C15C14C13H18120.0°120.5°
C15C14C13H1561.8°79.7°
C15C14C13H16178.8°161.8°
C15C14H17H18119.9°118.8°
C14C15H19H20120.6°118.5°
C14C13H15H16119.0°118.5°
C13C14H17H18119.9°119.0°
C13C14C15H19151.0°79.7°
C13C14C15H2030.6°161.8°
N4C9N3C7155.3°0.6°
N4C9N3C819.3°95.4°
C9N3C7C8175.6°111.7°
C9N3C7C6172.7°138.7°
C9N3C8C6173.1°138.7°
C9N3C7H1072.3°106.5°
C9N3C7H1157.6°24.0°
C9N3C8H1258.2°23.9°
C9N3C8H1372.0°106.5°
N3C7C6H10115.1°114.8°
N3C7C6H11115.1°114.7°
C7N3C8C62.8°27.0°
N3C7C6C5122.6°139.6°
N3C7H10H11132.8°130.8°
C7N3C8H12117.7°87.8°
C7N3C8H13112.1°141.8°
N3C7C6H9114.3°87.7°
N3C8C6H12114.9°114.8°
N3C8C6H13114.9°114.8°
N3C8C6C5117.4°139.7°
C8N3C7H10112.1°141.8°
C8N3C7H11118.0°87.8°
N3C8H12H13133.1°130.8°
N3C8C6H9115.3°87.7°
C7C6C8C5120.1°113.7°
C7C6C8H9112.5°113.7°
C7C6C5H9123.4°133.1°
C7C6C5O25.6°0.1°
C7C6C5N2154.9°180.0°
C6C7H10H11132.8°130.8°
C7C6C8H12117.6°88.8°
C7C6C8H13112.2°140.8°
C8C6C5H9127.2°133.0°
C8C6C5O83.8°93.9°
C8C6C5N295.6°86.2°
C8C6C7H10112.5°140.8°
C8C6C7H11117.7°88.7°
C6C8H12H13133.2°130.8°
C6C5ON2179.4°179.9°
C6C5N2C4178.3°180.0°
C5C6C7H10122.3°105.6°
C5C6C7H117.6°24.9°
C5C6C8H122.5°24.9°
C5C6C8H13127.7°105.5°
C6C5N2H81.7°0.0°
OC5N2C41.1°0.1°
OC5C6H9149.0°133.1°
OC5N2H8178.9°180.0°
C5N2C4H8180.0°180.0°
C5N2C4C380.8°180.0°
N2C5C6H931.5°46.9°
C5N2C4H6159.6°60.1°
C5N2C4H738.8°60.0°
N2C4C3H6119.6°119.9°
N2C4C3H7119.6°120.0°
N2C4C3C1128.6°90.0°
N2C4C3C1958.8°90.0°
N2C4H6H7121.2°120.0°
C4C3C1C19173.9°180.0°
C4C3C1C23.5°0.0°
C4C3C1N1180.0°179.9°
C4C3C19C207.8°0.1°
C4C3C19N178.2°179.7°
C3C4N2H899.2°0.0°
C3C4H6H7121.2°120.0°
C3C1C2N1176.1°179.9°
C3C1N1N4.9°0.2°
C1C3C19C20178.6°180.0°
C1C3C19N4.6°0.3°
C1C3C4H6111.7°29.9°
C1C3C4H79.1°150.0°
C3C1C2H3176.1°90.0°
C3C1C2H463.9°150.0°
C3C1C2H556.1°30.1°
C19C3C1C2177.4°179.9°
C19C3C1N16.0°0.0°
C3C19NN11.8°0.4°
C3C19C20N172.7°179.7°
C3C19NC179.8°179.8°
C3C19C20H2893.9°89.8°
C3C19C20H29146.1°30.2°
C3C19C20H3026.1°150.3°
C19C3C4H660.8°150.0°
C19C3C4H7178.4°30.0°
C2C1N1N178.1°179.7°
C1C2H3H4120.0°120.0°
C1C2H3H5120.0°120.0°
C1C2H4H5120.0°119.9°
C1N1NC192.0°0.4°
C1N1NC176.5°179.8°
N1C1C2H30.0°89.9°
N1C1C2H4120.0°30.2°
N1C1C2H5120.0°150.1°
N1NC19C20176.1°179.9°
N1NC19C178.4°179.8°
N1NCH0.0°89.8°
N1NCH1120.0°30.2°
N1NCH2120.0°150.2°
C20C19NC5.5°0.0°
C19C20H28H29120.0°120.0°
C19C20H28H30120.0°119.9°
C19C20H29H30120.0°120.0°
NC19C20H2893.3°89.9°
NC19C20H2926.7°150.0°
NC19C20H30146.6°30.0°
C19NCH178.4°89.9°
C19NCH161.6°150.0°
C19NCH258.4°30.0°
NCHH1120.0°120.0°
NCHH2120.0°119.9°
NCH1H2120.0°120.0°
H15C13C14H17178.2°159.7°
H15C13C14H1858.2°40.7°
H16C13C14H1758.8°41.2°
H16C13C14H1861.1°77.7°
H17C14C15H1989.0°40.9°
H17C14C15H20150.6°77.6°
H18C14C15H1931.0°159.7°
H18C14C15H2089.4°41.3°
H24C17C18H2686.4°58.0°
H24C17C18H2737.5°60.8°
H25C17C18H26154.5°60.7°
H25C17C18H2781.6°179.5°
H28C20H29H30120.0°120.0°
H21C16H22H23120.0°120.1°
H10C7C6H90.7°27.1°
H11C7C6H9130.6°157.6°
H12C8C6H9129.8°157.5°
H13C8C6H90.4°27.1°
H8N2C4H620.4°120.0°
H8N2C4H7141.2°120.0°
H3C2H4H5120.0°120.0°
HCH1H2120.0°120.0°

255615

PDB entries from 2026-06-24

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