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A8N

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C1C2doub1.53Å1.43ÅAromatic
C1C6sing1.53Å1.39ÅAromatic
C1H1sing1.09Å1.10Å
C2C3sing1.53Å1.40ÅAromatic
C2H2sing1.09Å1.10Å
C3C4doub1.51Å1.45ÅAromatic
C3H3sing1.09Å1.10Å
C4C5sing1.38Å1.44ÅAromatic
C4C7sing1.39Å1.47ÅAromatic
C5C6doub1.51Å1.46ÅAromatic
C5N10sing1.32Å1.42ÅAromatic
C6H6sing1.09Å1.10Å
C7C8doub1.41Å1.43ÅAromatic
C7N11sing1.39Å1.42Å
C8C9sing1.42Å1.47ÅAromatic
C8C13sing1.40Å1.54Å
C9N10doub1.33Å1.37ÅAromatic
C9C16sing1.41Å1.54Å
N10H101sing0.97Å1.02Å
N11C17sing1.47Å1.49Å
N11H11sing1.01Å1.02Å
C13C14sing1.36Å1.56Å
C13H131sing3.40Å1.11Å
C13H132sing1.08Å1.12Å
C14C15sing1.39Å1.56Å
C14H141sing4.64Å1.11Å
C14H142sing1.08Å1.11Å
C15C16sing1.36Å1.57Å
C15H151sing5.47Å1.11Å
C15H152sing1.08Å1.12Å
C16H161sing5.34Å1.12Å
C16H162sing1.08Å1.11Å
C17C18sing1.53Å1.55Å
C17H171sing1.09Å1.11Å
C17H172sing1.09Å1.11Å
C18C19sing1.53Å1.55Å
C18H181sing1.09Å1.12Å
C18H182sing1.09Å1.11Å
C19C20sing1.53Å1.55Å
C19H191sing1.09Å1.11Å
C19H192sing1.09Å1.12Å
C20C21sing1.53Å1.54Å
C20H201sing1.09Å1.12Å
C20H202sing1.09Å1.12Å
C21C22sing1.53Å1.55Å
C21H211sing1.09Å1.12Å
C21H212sing1.09Å1.12Å
C22C23sing1.53Å1.54Å
C22H221sing1.09Å1.11Å
C22H222sing1.09Å1.11Å
C23C24sing1.53Å1.53Å
C23H231sing1.09Å1.11Å
C23H232sing1.09Å1.11Å
C24N25sing1.47Å1.51Å
C24H241sing1.09Å1.12Å
C24H242sing1.09Å1.11Å
N25H251sing1.01Å1.02Å
N25H252sing1.01Å1.02Å
N25H253sing1.01Å1.02Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C2C1C6119.2°108.4°
C2C1H1120.4°109.7°
C1C2C3120.9°108.3°
C1C2H2119.5°109.7°
C6C1H1120.4°109.7°
C1C6C5120.8°110.6°
C1C6H6119.6°109.2°
C3C2H2119.5°109.7°
C2C3C4122.1°110.6°
C2C3H3119.0°109.3°
C4C3H3118.9°109.3°
C3C4C5116.1°122.8°
C3C4C7124.9°117.5°
C5C4C7119.0°119.7°
C4C5C6120.8°122.1°
C4C5N10120.6°121.0°
C4C7C8119.7°118.4°
C4C7N11119.6°120.8°
C6C5N10118.6°116.9°
C5C6H6119.6°109.3°
C5N10C9120.3°122.5°
C5N10H101108.4°118.7°
C8C7N11120.7°120.8°
C7C8C9118.0°118.6°
C7C8C13124.8°121.7°
C7N11C17124.3°106.6°
C7N11H11117.8°106.7°
C9C8C13117.2°119.7°
C8C9N10122.3°119.8°
C8C9C16123.9°119.0°
C8C13C14115.6°119.7°
C8C13H131110.0°66.5°
C8C13H132110.0°120.2°
N10C9C16113.7°121.2°
C9N10H101108.3°118.7°
C9C16C15112.9°119.8°
C9C16H161111.0°36.0°
C9C16H162111.0°120.1°
C17N11H11117.8°106.7°
N11C17C18112.2°109.4°
N11C17H171111.2°109.4°
N11C17H172111.2°109.5°
C14C13H131110.0°150.4°
C14C13H132110.0°120.2°
C13C14C15109.7°120.8°
C13C14H141112.1°21.3°
C13C14H142112.1°119.7°
H131C13H132100.3°61.9°
C15C14H141112.1°120.1°
C15C14H142112.1°119.5°
C14C15C16108.2°121.0°
C14C15H151112.7°47.2°
C14C15H152112.6°119.5°
H141C14H14298.3°115.9°
C16C15H151112.7°77.3°
C16C15H152112.7°119.4°
C15C16H161111.0°88.3°
C15C16H162111.0°120.1°
H151C15H15297.8°156.2°
H161C16H16299.3°146.7°
C18C17H171111.2°109.5°
C18C17H172111.2°109.5°
C17C18C19113.2°109.4°
C17C18H181110.8°109.5°
C17C18H182110.8°109.5°
H171C17H17299.1°109.5°
C19C18H181110.8°109.5°
C19C18H182110.8°109.4°
C18C19C20112.7°109.4°
C18C19H191111.0°109.5°
C18C19H192111.0°109.4°
H181C18H18299.5°109.5°
C20C19H191111.0°109.5°
C20C19H192111.0°109.5°
C19C20C21113.4°109.4°
C19C20H201110.8°109.5°
C19C20H202110.8°109.4°
H191C19H19299.3°109.5°
C21C20H201110.8°109.5°
C21C20H202110.8°109.5°
C20C21C22111.8°109.4°
C20C21H211111.3°109.5°
C20C21H212111.3°109.4°
H201C20H20299.5°109.5°
C22C21H211111.4°109.5°
C22C21H212111.3°109.5°
C21C22C23112.1°109.4°
C21C22H221111.3°109.5°
C21C22H222111.2°109.4°
H211C21H21299.0°109.5°
C23C22H221111.2°109.5°
C23C22H222111.3°109.5°
C22C23C24112.9°109.4°
C22C23H231111.0°109.5°
C22C23H232111.0°109.5°
H221C22H22299.1°109.5°
C24C23H231111.0°109.5°
C24C23H232111.0°109.4°
C23C24N25106.1°109.4°
C23C24H241113.4°109.5°
C23C24H242113.5°109.5°
H231C23H23299.4°109.5°
N25C24H241113.5°109.5°
N25C24H242113.4°109.5°
C24N25H251126.2°109.4°
C24N25H252126.2°109.5°
C24N25H253113.4°109.4°
H241C24H24297.0°109.5°
H251N25H25282.5°109.5°
H251N25H25379.0°109.5°
H252N25H253116.6°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C2C1C6H1180.0°119.7°
C1C2C3H2180.0°119.7°
C1C2C3C40.2°51.0°
C1C2C3H3179.8°171.3°
C2C1C6C50.2°51.5°
C2C1C6H6179.8°68.8°
C6C1C2C30.4°70.1°
C6C1C2H2179.6°49.6°
C1C6C5C40.2°17.9°
C1C6C5H6180.0°120.3°
C1C6C5N10179.8°162.2°
H1C1C2C3179.6°170.1°
H1C1C2H20.4°70.1°
H1C1C6C5179.8°171.2°
H1C1C6H60.2°50.9°
C2C3C4H3180.0°120.3°
C2C3C4C50.2°17.5°
C2C3C4C7179.1°162.7°
H2C2C3C4179.8°68.8°
H2C2C3H30.2°51.5°
C3C4C5C7179.3°179.8°
C3C4C5C60.4°0.5°
C3C4C5N10180.0°179.6°
C3C4C7C8177.0°180.0°
C3C4C7N112.9°0.2°
H3C3C4C5179.8°137.8°
H3C3C4C71.0°42.4°
C4C5C6N10179.6°179.8°
C4C5C6H6179.8°102.4°
C5C4C7C83.8°0.2°
C5C4C7N11176.4°180.0°
C4C5N10C91.6°0.1°
C4C5N10H101126.9°179.8°
C7C4C5C6178.9°179.7°
C7C4C5N100.7°0.2°
C4C7C8N11179.8°179.8°
C4C7C8C94.5°0.5°
C4C7C8C13173.0°179.8°
C4C7N11C1791.0°97.0°
C4C7N11H1189.0°149.3°
C6C5N10C9178.8°179.7°
C6C5N10H10153.5°0.3°
N10C5C6H60.2°77.5°
C5N10C9C80.7°0.2°
C5N10C9H101125.3°180.0°
C5N10C9C16179.3°179.9°
C7C8C9C13177.8°179.3°
C7C8C9N102.4°0.6°
C7C8C9C16177.6°179.7°
C8C7N11C1789.2°82.9°
C8C7N11H1190.9°30.9°
C7C8C13C14164.2°179.7°
C7C8C13H13138.9°32.8°
C7C8C13H13270.6°0.5°
N11C7C8C9175.6°179.6°
N11C7C8C136.8°0.4°
C7N11C17H11180.0°113.8°
C7N11C17C18155.0°174.8°
C7N11C17H17129.7°54.8°
C7N11C17H17279.8°65.2°
C8C9N10C16180.0°179.7°
C8C9N10H101126.0°179.8°
C9C8C13C1413.4°0.4°
C9C8C13H131138.7°147.9°
C9C8C13H132111.8°179.8°
C8C9C16C1513.3°0.2°
C8C9C16H161138.6°32.1°
C8C9C16H162111.9°179.8°
C13C8C9N10175.4°179.8°
C13C8C9C164.6°0.4°
C8C13C14H131125.3°94.3°
C8C13C14H132125.2°179.8°
C8C13H131H132115.8°148.4°
C8C13C14C1548.8°0.2°
C8C13C14H14176.4°94.3°
C8C13C14H142174.1°179.8°
N10C9C16C15166.6°179.9°
N10C9C16H16141.3°147.6°
N10C9C16H16268.1°0.1°
C16C9N10H10154.0°0.1°
C9C16C15C1447.5°0.0°
C9C16C15H161125.3°18.3°
C9C16C15H162125.3°180.0°
C9C16C15H15177.8°18.3°
C9C16C15H152172.7°180.0°
C9C16H161H162116.8°57.3°
N11C17C18H171125.3°119.9°
N11C17C18H172125.2°120.0°
N11C17H171H172117.1°120.0°
N11C17C18C19132.7°180.0°
N11C17C18H181102.0°60.0°
N11C17C18H1827.4°60.0°
H11N11C17C1825.0°71.5°
H11N11C17H171150.3°168.6°
H11N11C17H172100.2°48.5°
C14C13H131H132115.8°102.4°
C13C14C15H141125.3°24.7°
C13C14C15H142125.3°180.0°
C13C14H141H142118.0°105.7°
C13C14C15C1665.5°0.0°
C13C14C15H15159.8°24.7°
C13C14C15H152169.3°180.0°
H131C13C14C15174.1°94.5°
H131C13C14H14148.8°0.0°
H131C13C14H14260.6°85.5°
H132C13C14C1576.4°180.0°
H132C13C14H141158.3°85.5°
H132C13C14H14248.9°0.0°
C15C14H141H142118.0°156.1°
C14C15C16H151125.3°18.3°
C14C15C16H152125.2°180.0°
C14C15H151H152118.6°64.2°
C14C15C16H161172.8°18.3°
C14C15C16H16277.8°180.0°
H141C14C15C1659.8°24.7°
H141C14C15H151174.9°0.0°
H141C14C15H15265.4°155.3°
H142C14C15C16169.3°180.0°
H142C14C15H15165.5°155.3°
H142C14C15H15244.0°0.0°
C16C15H151H152118.6°137.4°
C15C16H161H162116.8°150.4°
H151C15C16H16147.5°0.0°
H151C15C16H162156.9°161.7°
H152C15C16H16162.0°161.7°
H152C15C16H16247.5°0.0°
C18C17H171H172117.1°120.1°
C17C18C19H181125.3°120.0°
C17C18C19H182125.2°120.0°
C17C18H181H182116.7°120.1°
C17C18C19C20133.0°180.0°
C17C18C19H191101.7°60.0°
C17C18C19H1927.7°60.0°
H171C17C18C197.4°60.0°
H171C17C18H181132.7°180.0°
H171C17C18H182117.9°59.9°
H172C17C18C19102.1°60.1°
H172C17C18H18123.2°60.0°
H172C17C18H182132.7°180.0°
C19C18H181H182116.7°120.0°
C18C19C20H191125.3°120.0°
C18C19C20H192125.3°119.9°
C18C19H191H192116.9°120.0°
C18C19C20C21134.3°180.0°
C18C19C20H2019.0°60.0°
C18C19C20H202100.5°60.0°
H181C18C19C207.7°60.0°
H181C18C19H191133.0°180.0°
H181C18C19H192117.5°60.0°
H182C18C19C20101.8°60.0°
H182C18C19H19123.5°60.0°
H182C18C19H192133.0°180.0°
C20C19H191H192116.9°120.0°
C19C20C21H201125.3°120.0°
C19C20C21H202125.3°119.9°
C19C20H201H202116.7°120.0°
C19C20C21C22128.8°180.0°
C19C20C21H2113.5°60.0°
C19C20C21H212105.9°60.0°
H191C19C20C21100.5°60.0°
H191C19C20H201134.3°180.0°
H191C19C20H20224.8°60.0°
H192C19C20C219.0°60.1°
H192C19C20H201116.3°59.9°
H192C19C20H202134.3°180.0°
C21C20H201H202116.6°120.1°
C20C21C22H211125.3°120.0°
C20C21C22H212125.3°119.9°
C20C21H211H212117.2°120.0°
C20C21C22C23125.5°180.0°
C20C21C22H2210.2°60.0°
C20C21C22H222109.2°60.0°
H201C20C21C22105.9°60.0°
H201C20C21H211128.8°180.0°
H201C20C21H21219.3°59.9°
H202C20C21C223.5°60.1°
H202C20C21H211121.7°59.9°
H202C20C21H212128.8°180.0°
C22C21H211H212117.2°120.0°
C21C22C23H221125.3°120.0°
C21C22C23H222125.3°120.0°
C21C22H221H222117.1°120.0°
C21C22C23C24129.2°180.0°
C21C22C23H2314.0°60.0°
C21C22C23H232105.5°60.0°
H211C21C22C23109.2°60.0°
H211C21C22H221125.5°180.0°
H211C21C22H22216.0°60.0°
H212C21C22C230.3°60.0°
H212C21C22H221125.0°59.9°
H212C21C22H222125.5°180.0°
C23C22H221H222117.1°120.1°
C22C23C24H231125.3°119.9°
C22C23C24H232125.3°120.0°
C22C23H231H232116.8°120.1°
C22C23C24N25125.4°180.0°
C22C23C24H2410.1°60.0°
C22C23C24H242109.4°60.0°
H221C22C23C24105.5°60.0°
H221C22C23H231129.3°NaN°
H221C22C23H23219.8°59.9°
H222C22C23C244.0°60.0°
H222C22C23H231121.3°59.9°
H222C22C23H232129.2°NaN°
C24C23H231H232116.8°120.0°
C23C24N25H241125.2°120.0°
C23C24N25H242125.3°120.0°
C23C24H241H242119.4°120.0°
C23C24N25H25138.6°60.0°
C23C24N25H252148.1°60.0°
C23C24N25H25354.7°179.9°
H231C23C24N25109.3°60.0°
H231C23C24H241125.4°180.0°
H231C23C24H24215.9°59.9°
H232C23C24N250.1°60.0°
H232C23C24H241125.1°60.0°
H232C23C24H242125.4°180.0°
N25C24H241H242119.4°120.0°
C24N25H251H252129.8°120.0°
C24N25H251H253111.1°119.9°
C24N25H252H253156.5°120.0°
H241C24N25H25186.6°180.0°
H241C24N25H25222.9°60.0°
H241C24N25H253180.0°60.1°
H242C24N25H251163.9°60.0°
H242C24N25H25286.6°180.0°
H242C24N25H25370.5°60.0°
H251N25H252H25373.6°120.1°

225946

PDB entries from 2024-10-09

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