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IM9

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C1C2sing1.53Å1.53Å
C2C3sing1.53Å1.53Å
C2N4sing1.47Å1.47Å
N4C5sing1.35Å1.35ÅAromatic
N4C9sing1.39Å1.39ÅAromatic
C5C6sing1.51Å1.51Å
C5N7doub1.32Å1.32ÅAromatic
N7C8sing1.34Å1.34ÅAromatic
C8C9doub1.36Å1.36ÅAromatic
C9C10sing1.47Å1.47ÅAromatic
C10C11sing1.41Å1.41ÅAromatic
C10N32doub1.36Å1.36ÅAromatic
C11C12doub1.38Å1.38ÅAromatic
C12N13sing1.33Å1.33ÅAromatic
N13C14doub1.33Å1.33ÅAromatic
C14N15sing1.39Å1.39Å
C14N32sing1.35Å1.35ÅAromatic
N15C16sing1.39Å1.39Å
C16C17sing1.40Å1.40ÅAromatic
C16C21doub1.39Å1.39ÅAromatic
C17C18doub1.39Å1.39ÅAromatic
C18C19sing1.39Å1.39ÅAromatic
C19C20doub1.39Å1.39ÅAromatic
C19N22sing1.42Å1.42Å
C20C21sing1.39Å1.39ÅAromatic
N22C23sing1.47Å1.47Å
N22C27sing1.47Å1.47Å
C23C24sing1.53Å1.53Å
C24N25sing1.48Å1.48Å
N25C26sing1.47Å1.47Å
N25C28sing1.35Å1.35Å
C26C27sing1.54Å1.54Å
C28O29doub1.23Å1.23Å
C28C30sing1.51Å1.51Å
C30O31sing1.44Å1.44Å
C1H1C1sing1.10Å1.10Å
C1H1C2sing1.10Å1.10Å
C1H1C3sing1.10Å1.10Å
C2H2sing1.10Å1.10Å
C3H3C1sing1.10Å1.10Å
C3H3C2sing1.10Å1.10Å
C3H3C3sing1.10Å1.10Å
C6H6C1sing1.10Å1.10Å
C6H6C2sing1.10Å1.10Å
C6H6C3sing1.10Å1.10Å
C8H8sing1.08Å1.08Å
C11H11sing1.08Å1.08Å
C12H12sing1.08Å1.08Å
N15H15sing1.00Å1.00Å
C17H17sing1.08Å1.08Å
C21H21sing1.08Å1.08Å
C18H18sing1.08Å1.08Å
C20H20sing1.08Å1.08Å
C23H231sing1.10Å1.10Å
C23H232sing1.10Å1.10Å
C27H271sing1.10Å1.10Å
C27H272sing1.10Å1.10Å
C24H241sing1.10Å1.10Å
C24H242sing1.10Å1.10Å
C26H261sing1.10Å1.10Å
C26H262sing1.10Å1.10Å
C30H301sing1.10Å1.10Å
C30H302sing1.10Å1.10Å
O31H31sing0.95Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C1C2C3110.1°110.1°
C1C2N4110.2°110.2°
C2C1H1C1109.5°109.5°
C2C1H1C2109.5°109.5°
C2C1H1C3109.5°109.5°
C1C2H2109.3°109.3°
C3C2N4111.7°111.7°
C3C2H2107.8°107.8°
C2C3H3C1109.5°109.5°
C2C3H3C2109.5°109.4°
C2C3H3C3109.5°109.5°
C2N4C5127.2°127.2°
C2N4C9126.9°126.9°
N4C2H2107.7°107.6°
C5N4C9105.9°105.9°
N4C5C6124.2°124.2°
N4C5N7109.6°109.6°
N4C9C8107.8°107.8°
N4C9C10126.2°126.2°
C6C5N7126.2°126.2°
C5C6H6C1109.5°109.5°
C5C6H6C2109.4°109.4°
C5C6H6C3109.4°109.5°
C5N7C8109.7°109.7°
N7C8C9106.9°106.9°
N7C8H8126.5°126.5°
C8C9C10126.0°126.0°
C9C8H8126.5°126.5°
C9C10C11119.3°119.3°
C9C10N32120.1°120.1°
C11C10N32120.6°120.6°
C10C11C12116.9°116.9°
C10C11H11121.6°121.6°
C10N32C14119.3°119.3°
C11C12N13120.3°120.3°
C12C11H11121.5°121.5°
C11C12H12119.9°119.9°
C12N13C14121.9°121.9°
N13C12H12119.8°119.8°
N13C14N15114.0°114.0°
N13C14N32121.0°121.0°
N15C14N32124.9°124.9°
C14N15C16130.7°130.7°
C14N15H15114.6°114.6°
N15C16C17125.2°125.2°
N15C16C21116.1°116.1°
C16N15H15114.7°114.7°
C17C16C21118.8°118.8°
C16C17C18118.9°118.9°
C16C17H17120.6°120.6°
C16C21C20122.4°122.4°
C16C21H21118.8°118.8°
C17C18C19122.0°122.0°
C18C17H17120.6°120.6°
C17C18H18119.0°119.0°
C18C19C20119.2°119.2°
C18C19N22121.3°121.3°
C19C18H18119.0°119.0°
C20C19N22119.5°119.5°
C19C20C21118.8°118.8°
C19C20H20120.6°120.6°
C19N22C23112.4°112.4°
C19N22C27110.8°110.8°
C20C21H21118.8°118.8°
C21C20H20120.6°120.6°
C23N22C27111.9°111.9°
N22C23C24108.4°108.4°
N22C23H231109.8°109.8°
N22C23H232110.1°110.1°
N22C27C26108.8°108.8°
N22C27H271109.7°109.7°
N22C27H272109.8°109.8°
C23C24N25108.7°108.7°
C24C23H231109.8°109.8°
C24C23H232110.1°110.0°
C23C24H241109.7°109.7°
C23C24H242109.9°109.9°
C24N25C26117.8°117.8°
C24N25C28122.0°122.0°
N25C24H241109.7°109.7°
N25C24H242109.9°109.9°
C26N25C28120.2°120.2°
N25C26C27106.2°106.2°
N25C26H261110.6°110.6°
N25C26H262111.3°111.3°
N25C28O29119.6°119.6°
N25C28C30120.4°120.4°
C26C27H271109.7°109.7°
C26C27H272109.9°109.9°
C27C26H261110.6°110.6°
C27C26H262111.3°111.3°
O29C28C30120.0°120.0°
C28C30O31111.7°111.7°
C28C30H301108.7°108.8°
C28C30H302108.3°108.3°
O31C30H301108.8°108.8°
O31C30H302108.2°108.2°
C30O31H31109.5°109.5°
H1C1C1H1C2109.5°109.4°
H1C1C1H1C3109.4°109.5°
H1C2C1H1C3109.5°109.5°
H3C1C3H3C2109.5°109.5°
H3C1C3H3C3109.4°109.4°
H3C2C3H3C3109.5°109.5°
H6C1C6H6C2109.4°109.4°
H6C1C6H6C3109.5°109.4°
H6C2C6H6C3109.5°109.5°
H231C23H232108.6°108.6°
H271C27H272108.9°108.9°
H241C24H242108.9°108.9°
H261C26H262106.9°106.9°
H301C30H302111.2°111.2°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C1C2C3N4122.8°122.8°
C1C2C3H2119.1°119.2°
C1C2N4H2119.1°119.1°
C1C2N4C562.6°62.6°
C1C2N4C9115.2°115.2°
C2C1H1C1H1C2120.0°120.0°
C2C1H1C1H1C3120.0°120.0°
C2C1H1C2H1C3120.0°120.0°
C1C2C3H3C1166.2°166.2°
C1C2C3H3C246.1°46.1°
C1C2C3H3C373.9°73.9°
C3C2N4H2118.1°118.1°
C3C2N4C560.1°60.1°
C3C2N4C9122.0°122.0°
C3C2C1H1C194.8°94.9°
C3C2C1H1C2145.2°145.1°
C3C2C1H1C325.1°25.1°
C2C3H3C1H3C2120.0°120.0°
C2C3H3C1H3C3120.0°120.0°
C2C3H3C2H3C3120.0°120.0°
C2N4C5C9178.2°178.2°
C2N4C5C61.3°1.3°
C2N4C5N7178.1°178.1°
C2N4C9C8178.7°178.7°
C2N4C9C102.1°2.1°
N4C2C1H1C1141.5°141.4°
N4C2C1H1C221.5°21.5°
N4C2C1H1C398.5°98.5°
N4C2C3H3C171.0°71.0°
N4C2C3H3C2168.9°169.0°
N4C2C3H3C349.0°49.0°
N4C5C6N7179.3°179.3°
N4C5N7C80.7°0.7°
C5N4C9C80.5°0.5°
C5N4C9C10179.7°179.7°
C5N4C2H2178.3°178.3°
N4C5C6H6C173.1°73.1°
N4C5C6H6C246.9°46.9°
N4C5C6H6C3166.9°166.9°
C9N4C5C6179.5°179.5°
C9N4C5N70.1°0.1°
N4C9C8N70.9°0.9°
N4C9C8C10179.2°179.2°
N4C9C10C11153.2°153.2°
N4C9C10N3225.9°25.9°
C9N4C2H23.9°3.9°
N4C9C8H8179.1°179.1°
C6C5N7C8179.9°179.9°
C5C6H6C1H6C2120.0°120.0°
C5C6H6C1H6C3120.0°120.0°
C5C6H6C2H6C3120.0°120.0°
C5N7C8C91.0°1.0°
N7C5C6H6C1107.6°107.6°
N7C5C6H6C2132.5°132.5°
N7C5C6H6C312.4°12.4°
C5N7C8H8179.0°179.0°
N7C8C9H8180.0°180.0°
N7C8C9C10179.9°179.9°
C8C9C10C1127.7°27.7°
C8C9C10N32153.1°153.1°
C9C10C11N32179.1°179.1°
C9C10C11C12179.3°179.3°
C9C10N32C14179.4°179.4°
C10C9C8H80.1°0.1°
C9C10C11H110.7°0.7°
C10C11C12H11180.0°180.0°
C10C11C12N130.9°0.9°
C11C10N32C140.3°0.3°
C10C11C12H12179.1°179.1°
N32C10C11C121.6°1.6°
C10N32C14N131.8°1.8°
C10N32C14N15180.0°180.0°
N32C10C11H11178.4°178.4°
C11C12N13H12180.0°180.0°
C11C12N13C141.1°1.1°
C12N13C14N15179.1°179.1°
C12N13C14N322.5°2.5°
N13C12C11H11179.1°179.1°
N13C14N15N32178.3°178.3°
N13C14N15C16167.1°167.1°
C14N13C12H12178.9°178.9°
N13C14N15H1512.9°12.8°
C14N15C16H15180.0°180.0°
C14N15C16C178.4°8.4°
C14N15C16C21172.9°172.9°
N32C14N15C1614.6°14.6°
N32C14N15H15165.4°165.5°
N15C16C17C21178.6°178.6°
N15C16C17C18179.8°179.8°
N15C16C21C20179.4°179.4°
N15C16C17H170.2°0.2°
N15C16C21H210.6°0.6°
C16C17C18H17180.0°180.0°
C16C17C18C190.4°0.4°
C17C16C21C201.8°1.8°
C17C16N15H15171.6°171.6°
C17C16C21H21178.2°178.2°
C16C17C18H18179.6°179.6°
C21C16C17C181.6°1.6°
C16C21C20C190.8°0.8°
C16C21C20H21180.0°180.0°
C21C16N15H157.1°7.1°
C21C16C17H17178.4°178.4°
C16C21C20H20179.2°179.2°
C17C18C19H18180.0°180.0°
C17C18C19C200.6°0.6°
C17C18C19N22178.3°178.3°
C18C19C20N22177.7°177.7°
C18C19C20C210.4°0.4°
C18C19N22C238.2°8.2°
C18C19N22C27134.3°134.3°
C19C18C17H17179.6°179.6°
C18C19C20H20179.6°179.6°
C19C20C21H20180.0°180.0°
C20C19N22C23174.2°174.2°
C20C19N22C2748.1°48.1°
C19C20C21H21179.2°179.2°
C20C19C18H18179.4°179.4°
N22C19C20C21178.1°178.1°
C19N22C23C27125.5°125.5°
C19N22C23C24171.9°171.9°
C19N22C27C26168.7°168.7°
N22C19C18H181.8°1.8°
N22C19C20H201.9°1.9°
C19N22C23H23151.9°51.9°
C19N22C23H23267.6°67.7°
C19N22C27H27171.3°71.3°
C19N22C27H27248.4°48.4°
N22C23C24H231120.0°120.0°
N22C23C24H232120.4°120.4°
N22C23C24N2553.4°53.4°
C23N22C27C2664.9°64.9°
N22C23H231H232120.4°120.5°
C23N22C27H27155.1°55.1°
C23N22C27H272174.8°174.8°
N22C23C24H24166.6°66.6°
N22C23C24H242173.7°173.7°
C27N22C23C2462.6°62.6°
N22C27C26N2556.6°56.6°
N22C27C26H271120.0°120.0°
N22C27C26H272120.3°120.3°
C27N22C23H231177.4°177.4°
C27N22C23H23257.9°57.8°
N22C27H271H272120.3°120.3°
N22C27C26H26163.4°63.4°
N22C27C26H262177.9°177.9°
C23C24N25H241120.0°120.0°
C23C24N25H242120.3°120.3°
C23C24N25C2654.1°54.1°
C23C24N25C28126.1°126.1°
C24C23H231H232120.5°120.4°
C23C24H241H242120.3°120.3°
C24N25C26C28179.7°179.7°
C24N25C26C2754.8°54.8°
C24N25C28O29178.1°178.1°
C24N25C28C301.2°1.2°
N25C24C23H231173.4°173.4°
N25C24C23H23267.0°67.0°
N25C24H241H242120.3°120.3°
C24N25C26H26165.2°65.2°
C24N25C26H262176.1°176.1°
N25C26C27H261120.0°120.0°
N25C26C27H262121.3°121.3°
C26N25C28O291.6°1.6°
C26N25C28C30179.1°179.1°
N25C26C27H27163.4°63.4°
N25C26C27H272176.9°176.9°
C26N25C24H24165.9°65.9°
C26N25C24H242174.4°174.4°
N25C26H261H262121.4°121.4°
C28N25C26C27125.4°125.4°
N25C28O29C30179.3°179.3°
N25C28C30O31176.6°176.6°
C28N25C24H241113.9°113.9°
C28N25C24H2425.9°5.9°
C28N25C26H261114.6°114.6°
C28N25C26H2624.2°4.2°
N25C28C30H30156.6°56.6°
N25C28C30H30264.3°64.3°
C26C27H271H272120.3°120.3°
C27C26H261H262121.3°121.3°
O29C28C30O312.7°2.7°
O29C28C30H301122.7°122.7°
O29C28C30H302116.4°116.4°
C28C30O31H301120.0°120.0°
C28C30O31H302119.1°119.1°
C28C30H301H302119.1°119.1°
C28C30O31H3124.8°24.8°
O31C30H301H302119.1°119.1°
H1C1C1H1C2H1C3120.0°120.0°
H1C1C1C2H223.4°23.3°
H1C2C1C2H296.7°96.7°
H1C3C1C2H2143.3°143.3°
H2C2C3H3C147.1°47.0°
H2C2C3H3C273.0°73.0°
H2C2C3H3C3167.0°167.0°
H3C1C3H3C2H3C3119.9°120.0°
H6C1C6H6C2H6C3120.0°120.0°
H11C11C12H120.9°0.9°
H17C17C18H180.4°0.4°
H21C21C20H200.8°0.8°
H231C23C24H24153.4°53.4°
H231C23C24H24266.3°66.3°
H232C23C24H241173.0°173.0°
H232C23C24H24253.3°53.3°
H271C27C26H261176.6°176.6°
H271C27C26H26257.9°57.9°
H272C27C26H26156.9°56.9°
H272C27C26H26261.8°61.8°
H301C30O31H31144.8°144.8°
H302C30O31H3194.3°94.3°

223790

PDB entries from 2024-08-14

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