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I17

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C26N9sing1.47Å1.49Å
C26C30sing1.54Å1.50Å
C26C27sing1.54Å1.54Å
C26H261sing1.09Å1.11Å
N9C4sing1.37Å1.38ÅAromatic
N9C8sing1.37Å1.41ÅAromatic
C4N3doub1.33Å1.35ÅAromatic
C4C5sing1.40Å1.39ÅAromatic
N3C2sing1.32Å1.30ÅAromatic
C2N1doub1.33Å1.40ÅAromatic
C2N10sing1.39Å1.50Å
C6N1sing1.33Å1.41ÅAromatic
C6C5doub1.41Å1.46ÅAromatic
C6N18sing1.38Å1.43Å
C5N7sing1.36Å1.37ÅAromatic
N7C8doub1.30Å1.34ÅAromatic
C8H81sing1.08Å1.10Å
N18C19sing1.47Å1.46Å
N18H181sing0.97Å1.02Å
C19C20sing1.51Å1.36Å
C19H191sing1.09Å1.12Å
C19H192sing1.09Å1.12Å
C25C24doub1.38Å1.41ÅAromatic
C25C20sing1.38Å1.39ÅAromatic
C25H251sing1.08Å1.10Å
C24C23sing1.38Å1.38ÅAromatic
C24H241sing1.08Å1.10Å
C23C22doub1.38Å1.41ÅAromatic
C23H231sing1.08Å1.10Å
C22C21sing1.38Å1.42ÅAromatic
C22H221sing1.08Å1.10Å
C21C20doub1.38Å1.38ÅAromatic
C21H211sing1.08Å1.10Å
N10C11sing1.46Å1.57Å
N10H101sing0.97Å1.02Å
C11C16sing1.53Å1.50Å
C11C12sing1.53Å1.62Å
C11H111sing1.09Å1.11Å
C14C15sing1.53Å1.51Å
C14C13sing1.53Å1.50Å
C14N17sing1.47Å1.52Å
C14H141sing1.09Å1.12Å
C15C16sing1.53Å1.53Å
C15H151sing1.09Å1.11Å
C15H152sing1.09Å1.12Å
C16H161sing1.09Å1.12Å
C16H162sing1.09Å1.11Å
C12C13sing1.53Å1.54Å
C12H121sing1.09Å1.11Å
C12H122sing1.09Å1.12Å
C13H131sing1.09Å1.12Å
C13H132sing1.09Å1.11Å
N17H171sing1.01Å1.02Å
N17H172sing1.01Å1.02Å
C30C29sing1.54Å1.46Å
C30H301sing1.09Å1.11Å
C30H302sing1.09Å1.12Å
C29C28sing1.55Å1.43Å
C29H291sing1.09Å1.11Å
C29H292sing1.09Å1.12Å
C27C28sing1.55Å1.49Å
C27H271sing1.09Å1.12Å
C27H272sing1.09Å1.11Å
C28H281sing1.09Å1.11Å
C28H282sing1.09Å1.12Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
N9C26C30133.0°110.0°
N9C26C27111.1°110.1°
N9C26H26186.6°109.9°
C26N9C4124.9°126.4°
C26N9C8129.0°126.2°
C30C26C27101.9°106.6°
C30C26H26199.1°110.1°
C26C30C29106.9°106.6°
C26C30H301113.2°110.0°
C26C30H302113.2°110.0°
C27C26H261127.7°110.1°
C26C27C28102.0°104.2°
C26C27H271115.1°110.5°
C26C27H272115.1°110.5°
C4N9C8106.2°107.4°
N9C4N3124.9°134.8°
N9C4C5105.7°106.1°
N9C8N7111.6°109.9°
N9C8H81126.4°125.0°
N3C4C5129.4°119.1°
C4N3C2114.4°120.6°
C4C5C6114.6°118.3°
C4C5N7111.7°107.1°
N3C2N1124.2°122.2°
N3C2N10117.7°118.8°
N1C2N10118.1°118.9°
C2N1C6121.9°121.2°
C2N10C11121.6°120.0°
C2N10H101107.9°120.0°
N1C6C5115.5°118.5°
N1C6N18120.8°120.8°
C5C6N18123.7°120.7°
C6C5N7133.7°134.5°
C6N18C19117.7°119.9°
C6N18H181109.2°120.1°
C5N7C8104.8°109.4°
N7C8H81122.0°125.0°
C19N18H181109.2°120.0°
N18C19C20124.1°109.5°
N18C19H191107.1°109.5°
N18C19H192107.1°109.5°
C20C19H191107.0°109.5°
C20C19H192107.0°109.4°
C19C20C25117.3°120.0°
C19C20C21122.2°120.1°
H191C19H192102.6°109.4°
C24C25C20119.9°120.0°
C24C25H251120.7°120.0°
C25C24C23120.7°120.0°
C25C24H241120.4°120.0°
C20C25H251119.5°120.0°
C25C20C21120.5°120.0°
C23C24H241118.9°120.0°
C24C23C22119.5°120.0°
C24C23H231119.5°120.0°
C22C23H231121.0°120.0°
C23C22C21119.7°120.0°
C23C22H221119.5°120.0°
C21C22H221120.7°120.0°
C22C21C20119.7°120.0°
C22C21H211121.5°120.0°
C20C21H211118.8°120.0°
C11N10H101107.9°120.0°
N10C11C16107.5°109.5°
N10C11C12103.8°109.4°
N10C11H111116.1°109.5°
C16C11C12114.4°109.4°
C16C11H111105.9°109.5°
C11C16C15113.1°109.5°
C11C16H161110.9°109.5°
C11C16H162110.9°109.4°
C12C11H111109.4°109.5°
C11C12C13109.3°109.5°
C11C12H121112.3°109.5°
C11C12H122112.3°109.5°
C15C14C13108.1°109.5°
C15C14N17109.9°109.5°
C15C14H141110.1°109.4°
C14C15C16111.6°109.5°
C14C15H151111.4°109.5°
C14C15H152111.4°109.4°
C13C14N17109.3°109.5°
C13C14H141110.6°109.5°
C14C13C12114.9°109.4°
C14C13H131110.2°109.4°
C14C13H132110.2°109.5°
N17C14H141108.8°109.5°
C14N17H171109.8°106.7°
C14N17H172112.1°106.7°
C16C15H151111.5°109.5°
C16C15H152111.4°109.5°
C15C16H161110.8°109.5°
C15C16H162110.9°109.5°
H151C15H15299.0°109.5°
H161C16H16299.5°109.5°
C13C12H121112.3°109.4°
C13C12H122112.2°109.4°
C12C13H131110.2°109.5°
C12C13H132110.2°109.5°
H121C12H12298.1°109.5°
H131C13H132100.0°109.5°
H171N17H172112.1°106.7°
C29C30H301113.2°110.0°
C29C30H302113.2°110.1°
C30C29C28104.6°104.2°
C30C29H291114.1°110.5°
C30C29H292114.1°110.5°
H301C30H30297.3°110.1°
C28C29H291114.1°110.5°
C28C29H292114.1°110.5°
C29C28C27100.4°102.7°
C29C28H281115.7°110.7°
C29C28H282115.7°110.8°
H291C29H29296.4°110.5°
C28C27H271115.1°110.5°
C28C27H272115.1°110.5°
C27C28H281115.7°110.8°
C27C28H282115.7°110.8°
H271C27H27295.3°110.5°
H281C28H28294.8°110.8°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
N9C26C30C27134.4°119.3°
N9C26C30H26193.8°121.3°
N9C26C27H261102.6°121.3°
C26N9C4C8179.7°179.8°
C26N9C4N30.1°0.1°
C26N9C4C5180.0°179.9°
C26N9C8N7179.9°180.0°
C26N9C8H810.1°0.2°
N9C26C30C29136.7°119.4°
N9C26C30H30198.0°121.4°
N9C26C30H30211.5°0.0°
N9C26C27C28176.0°142.9°
N9C26C27H27150.7°24.2°
N9C26C27H27258.7°98.4°
C30C26C27H261111.5°119.4°
C30C26N9C450.9°120.1°
C30C26N9C8129.5°60.1°
C26C30C29H301125.3°119.2°
C26C30C29H302125.2°119.3°
C26C30H301H302119.1°121.4°
C26C30C29C2827.6°23.6°
C26C30C29H291152.9°142.3°
C26C30C29H29297.6°95.1°
C30C26C27C2830.1°23.7°
C30C26C27H27195.2°95.1°
C30C26C27H272155.4°142.3°
C27C26N9C480.6°122.7°
C27C26N9C899.1°57.1°
C27C26C30C292.4°0.1°
C27C26C30H301127.6°119.3°
C27C26C30H302122.9°119.3°
C26C27C28C2947.4°38.0°
C26C27C28H271125.3°118.8°
C26C27C28H272125.3°118.7°
C26C27H271H272120.9°122.6°
C26C27C28H28177.9°80.3°
C26C27C28H282172.6°156.3°
H261C26N9C4150.1°1.3°
H261C26N9C830.2°178.5°
H261C26C30C29129.4°119.3°
H261C26C30H3014.2°0.1°
H261C26C30H302105.3°121.3°
H261C26C27C2881.4°95.7°
H261C26C27H271153.3°145.5°
H261C26C27H27243.9°23.0°
N9C4N3C5179.8°179.8°
N9C4N3C2179.7°179.7°
N9C4C5C6180.0°179.9°
N9C4C5N70.4°0.0°
C4N9C8N70.2°0.1°
C4N9C8H81179.8°180.0°
C8N9C4N3179.8°179.8°
C8N9C4C50.3°0.1°
N9C8N7C50.1°0.1°
N9C8N7H81180.0°179.9°
C4N3C2N10.1°0.5°
C4N3C2N10177.2°179.8°
N3C4C5C60.2°0.2°
N3C4C5N7179.8°179.8°
C5C4N3C20.1°0.5°
C4C5C6N10.4°0.0°
C4C5C6N7179.5°179.9°
C4C5C6N18179.4°179.9°
C4C5N7C80.3°0.0°
N3C2N1N10177.1°179.7°
N3C2N1C60.2°0.3°
N3C2N10C113.7°179.8°
N3C2N10H101129.0°0.3°
C2N1C6C50.5°0.0°
C2N1C6N18179.4°180.0°
N1C2N10C11173.6°0.1°
N1C2N10H10148.3°180.0°
N10C2N1C6176.9°180.0°
C2N10C11H101125.3°179.9°
C2N10C11C1664.6°150.0°
C2N10C11C12173.9°90.1°
C2N10C11H11153.7°30.0°
N1C6C5N18179.8°179.9°
N1C6C5N7179.9°179.9°
N1C6N18C190.9°0.1°
N1C6N18H181126.1°179.9°
C6C5N7C8179.8°179.9°
C5C6N18C19179.0°180.0°
C5C6N18H18153.7°0.1°
N18C6C5N70.1°0.2°
C6N18C19H181125.2°179.9°
C6N18C19C20121.0°180.0°
C6N18C19H191113.7°59.9°
C6N18C19H1924.3°60.0°
C5N7C8H81180.0°180.0°
N18C19C20H191125.3°120.1°
N18C19C20H192125.3°120.0°
N18C19H191H192112.5°120.0°
N18C19C20C2571.2°90.0°
N18C19C20C21108.7°90.2°
H181N18C19C20113.8°0.1°
H181N18C19H19111.5°119.9°
H181N18C19H192121.0°120.1°
C20C19H191H192112.5°119.9°
C19C20C25C24179.9°180.0°
C19C20C25C21179.9°179.8°
C19C20C25H2510.2°0.1°
C19C20C21C22179.7°179.7°
C19C20C21H2110.3°0.2°
H191C19C20C2554.1°30.1°
H191C19C20C21126.0°149.7°
H192C19C20C25163.5°150.0°
H192C19C20C2116.6°29.8°
C24C25C20H251179.9°179.9°
C25C24C23H241179.9°180.0°
C25C24C23C220.1°0.0°
C25C24C23H231180.0°179.9°
C24C25C20C210.1°0.2°
C20C25C24C230.1°0.0°
C20C25C24H241179.9°180.0°
C25C20C21C220.2°0.5°
C25C20C21H211179.8°180.0°
H251C25C24C23180.0°180.0°
H251C25C24H2410.1°0.1°
H251C25C20C21179.9°179.7°
C24C23C22H231180.0°180.0°
C24C23C22C210.1°0.2°
C24C23C22H221180.0°180.0°
H241C24C23C22179.9°180.0°
H241C24C23H2310.1°0.0°
C23C22C21H221179.9°179.8°
C23C22C21C200.2°0.5°
C23C22C21H211179.8°180.0°
H231C23C22C21179.9°179.8°
H231C23C22H2210.0°0.0°
C22C21C20H211179.9°179.5°
H221C22C21C20179.9°179.7°
H221C22C21H2110.2°0.2°
N10C11C16C12114.7°120.0°
N10C11C16H111124.7°120.1°
N10C11C12H111124.6°120.0°
N10C11C16C15160.8°180.0°
N10C11C16H16135.6°59.9°
N10C11C16H16273.9°60.0°
N10C11C12C13159.1°180.0°
N10C11C12H12175.7°60.0°
N10C11C12H12233.8°60.0°
H101N10C11C1660.7°29.9°
H101N10C11C1260.8°90.0°
H101N10C11H111179.0°150.0°
C16C11C12H111118.6°120.0°
C11C16C15C1456.2°60.0°
C11C16C15H161125.2°120.0°
C11C16C15H162125.3°120.0°
C11C16C15H15169.1°180.0°
C11C16C15H152178.6°60.0°
C11C16H161H162116.8°119.9°
C16C11C12C1342.2°60.0°
C16C11C12H121167.5°60.0°
C16C11C12H12283.0°180.0°
C11C12C13C1450.2°60.0°
C12C11C16C1546.1°60.0°
C12C11C16H16179.1°60.0°
C12C11C16H162171.4°180.0°
C11C12C13H121125.3°120.0°
C11C12C13H122125.3°120.0°
C11C12H121H122118.2°120.0°
C11C12C13H131175.5°59.9°
C11C12C13H13275.0°180.0°
H111C11C16C1574.5°60.0°
H111C11C16H161160.3°180.0°
H111C11C16H16250.8°60.0°
H111C11C12C1376.4°60.0°
H111C11C12H12148.9°180.0°
H111C11C12H122158.4°60.0°
C15C14C13N17119.6°120.0°
C15C14C13H141120.6°120.0°
C15C14N17H141120.6°120.0°
C14C15C16H151125.2°120.0°
C14C15C16H152125.2°120.0°
C14C15H151H152117.3°120.0°
C14C15C16H16169.1°60.0°
C14C15C16H162178.6°180.0°
C15C14C13C1260.6°60.0°
C15C14C13H131174.1°60.0°
C15C14C13H13264.7°180.0°
C15C14N17H171180.0°180.0°
C15C14N17H17254.8°66.3°
C13C14N17H141120.9°120.0°
C13C14C15C1661.2°60.0°
C13C14C15H15164.1°180.0°
C13C14C15H152173.5°60.0°
C14C13C12H131125.2°120.0°
C14C13C12H132125.3°120.0°
C14C13C12H121175.6°60.0°
C14C13C12H12275.0°180.0°
C14C13H131H132116.0°120.0°
C13C14N17H17161.6°60.0°
C13C14N17H17263.7°53.8°
N17C14C15C16179.5°180.0°
N17C14C15H15155.2°60.0°
N17C14C15H15254.3°60.0°
N17C14C13C12179.8°180.0°
N17C14C13H13154.5°60.0°
N17C14C13H13254.9°60.0°
C14N17H171H172125.3°113.7°
H141C14C15C1659.7°60.0°
H141C14C15H151175.0°60.0°
H141C14C15H15265.6°180.0°
H141C14C13C1259.9°60.0°
H141C14C13H13165.3°180.0°
H141C14C13H132174.8°60.0°
H141C14N17H17159.4°60.0°
H141C14N17H172175.4°173.8°
C16C15H151H152117.4°120.0°
C15C16H161H162116.7°120.0°
H151C15C16H161165.7°60.0°
H151C15C16H16256.2°60.0°
H152C15C16H16156.2°180.0°
H152C15C16H16253.3°60.0°
C13C12H121H122118.1°119.9°
C12C13H131H132116.1°120.0°
H121C12C13H13159.2°180.0°
H121C12C13H13250.3°60.0°
H122C12C13H13150.2°60.0°
H122C12C13H132159.7°60.0°
C29C30H301H302119.1°121.5°
C30C29C28H291125.3°118.7°
C30C29C28H292125.3°118.7°
C30C29H291H292120.0°122.6°
C30C29C28C2746.7°37.9°
C30C29C28H28178.6°80.3°
C30C29C28H282171.9°156.3°
H301C30C29C2897.6°95.7°
H301C30C29H29127.7°23.1°
H301C30C29H292137.1°145.6°
H302C30C29C28152.9°142.9°
H302C30C29H29181.8°98.4°
H302C30C29H29227.6°24.2°
C28C29H291H292119.9°122.6°
C29C28C27H281125.3°118.3°
C29C28C27H282125.2°118.3°
C29C28C27H27177.9°80.8°
C29C28C27H272172.7°156.7°
C29C28H281H282121.5°123.4°
H291C29C28C27172.0°156.7°
H291C29C28H28146.7°38.4°
H291C29C28H28262.8°85.0°
H292C29C28C2778.6°80.7°
H292C29C28H281156.1°161.0°
H292C29C28H28246.6°37.6°
C28C27H271H272120.9°122.6°
C27C28H281H282121.5°123.4°
H271C27C28H281156.8°160.9°
H271C27C28H28247.3°37.6°
H272C27C28H28147.4°38.4°
H272C27C28H28262.1°85.0°

224931

PDB entries from 2024-09-11

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