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WN5

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C01C02doub1.40Å1.44ÅAromatic
C02C03sing1.40Å1.34ÅAromatic
C01N04sing1.32Å1.32ÅAromatic
C03C05doub1.40Å1.51ÅAromatic
N04C06doub1.33Å1.36ÅAromatic
C05C06sing1.37Å1.41ÅAromatic
C06C07sing1.51Å1.52Å
C05C08sing1.51Å1.46Å
C07C09sing1.53Å1.57Å
C08C10sing1.53Å1.40Å
C09C11sing1.53Å1.57Å
C10C11sing1.53Å1.47Å
C03C12sing1.48Å1.42Å
C12C13doub1.39Å1.26ÅAromatic
C13C14sing1.38Å1.41ÅAromatic
C14C15doub1.38Å1.41ÅAromatic
C15C16sing1.38Å1.44ÅAromatic
C12C17sing1.39Å1.43ÅAromatic
C16C17doub1.38Å1.40ÅAromatic
C02C18sing1.48Å1.47Å
C01O19sing1.36Å1.32Å
O19C20sing1.43Å1.38Å
C20C21sing1.54Å1.45Å
C21O22sing1.43Å1.42Å
O22C23sing1.44Å1.40Å
C20C24sing1.55Å1.40Å
C23C24sing1.55Å1.48Å
C18N25sing1.36Å1.37ÅAromatic
N25N26sing1.41Å1.34ÅAromatic
N26N27doub1.29Å1.36ÅAromatic
C18N28doub1.32Å1.30ÅAromatic
N27N28sing1.28Å1.34ÅAromatic
C07H30sing1.09Å1.10Å
C07H29sing1.09Å1.10Å
C10H36sing1.09Å1.10Å
C10H35sing1.09Å1.10Å
C11H38sing1.09Å1.10Å
C11H37sing1.09Å1.10Å
C13H39sing1.08Å1.08Å
C15H41sing1.08Å1.08Å
C16H42sing1.08Å1.08Å
C17H43sing1.08Å1.08Å
C20H44sing1.09Å1.10Å
C21H45sing1.09Å1.10Å
C21H46sing1.09Å1.10Å
C23H48sing1.09Å1.10Å
C23H47sing1.09Å1.10Å
C24H50sing1.09Å1.10Å
C24H49sing1.09Å1.10Å
C08H31sing1.09Å1.10Å
C08H32sing1.09Å1.10Å
C09H33sing1.09Å1.10Å
C09H34sing1.09Å1.10Å
C14H40sing1.08Å1.08Å
N25H51sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C01C02C03120.5°118.3°
C02C01N04125.2°120.3°
C01C02C18116.0°120.8°
C02C01O19117.3°119.9°
C02C03C05117.1°118.7°
C02C03C12115.8°120.6°
C03C02C18123.4°120.9°
C01N04C06114.8°122.9°
N04C01O19117.1°119.8°
C03C05C06115.4°119.2°
C03C05C08128.2°117.2°
C05C03C12127.1°120.6°
N04C06C05126.4°120.5°
N04C06C07112.2°117.1°
C05C06C07120.9°122.4°
C06C05C08116.4°123.6°
C06C07C09116.7°111.0°
C06C07H30107.6°109.1°
C06C07H29107.6°109.2°
C05C08C10116.1°111.5°
C05C08H31107.8°109.1°
C05C08H32107.8°109.1°
C07C09C11111.0°107.8°
C09C07H30107.6°109.2°
C09C07H29107.6°109.2°
C07C09H33109.1°109.8°
C07C09H34109.1°109.8°
C08C10C11108.2°108.3°
C08C10H36109.8°109.7°
C08C10H35109.8°109.7°
C10C08H31107.8°109.0°
C10C08H32107.8°109.0°
C09C11C10124.8°109.7°
C09C11H38105.6°109.4°
C09C11H37105.6°109.4°
C11C09H33109.1°109.8°
C11C09H34109.1°109.8°
C11C10H36109.8°109.7°
C11C10H35109.8°109.7°
C10C11H38105.5°109.4°
C10C11H37105.5°109.5°
C03C12C13118.3°120.1°
C03C12C17120.9°120.1°
C12C13C14121.6°119.8°
C13C12C17120.7°119.8°
C12C13H39119.2°120.1°
C13C14C15122.0°120.1°
C14C13H39119.2°120.0°
C13C14H40119.0°119.9°
C14C15C16115.6°120.3°
C14C15H41122.2°119.8°
C15C14H40119.0°120.0°
C15C16C17119.2°120.1°
C16C15H41122.2°119.9°
C15C16H42120.4°119.9°
C12C17C16120.6°119.9°
C12C17H43119.7°120.1°
C17C16H42120.4°120.0°
C16C17H43119.7°120.1°
C02C18N25124.8°126.6°
C02C18N28124.2°126.5°
C01O19C20117.4°117.0°
O19C20C21104.5°110.9°
O19C20C24103.4°110.8°
O19C20H44114.1°110.9°
C20C21O22103.0°107.6°
C21C20C24107.2°102.3°
C21C20H44112.9°110.9°
C20C21H45111.1°109.9°
C20C21H46111.1°109.8°
C21O22C23108.5°110.0°
O22C21H45111.1°109.8°
O22C21H46111.1°109.8°
O22C23C24107.3°105.1°
O22C23H48110.0°110.4°
O22C23H47110.0°110.4°
C20C24C23102.2°100.9°
C24C20H44113.8°110.8°
C20C24H50111.2°111.1°
C20C24H49111.2°111.1°
C24C23H48110.0°110.3°
C24C23H47110.0°110.2°
C23C24H50111.3°111.1°
C23C24H49111.2°111.1°
C18N25N26105.1°105.1°
N25C18N28111.0°106.9°
C18N25H51127.5°127.4°
N25N26N27108.5°106.9°
N26N25H51127.5°127.5°
N26N27N28107.9°110.6°
C18N28N27107.4°110.5°
H30C07H29109.5°109.1°
H36C10H35109.5°109.6°
H38C11H37109.4°109.4°
H45C21H46109.5°109.9°
H48C23H47109.5°110.3°
H50C24H49109.5°111.0°
H31C08H32109.5°109.0°
H33C09H34109.5°109.8°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C01C02C03C18175.4°180.0°
C02C01N04O19172.4°179.7°
C01C02C03C052.0°0.0°
C02C01N04C067.8°0.1°
C01C02C03C12180.0°180.0°
C02C01O19C20163.3°180.0°
C01C02C18N2590.5°0.0°
C01C02C18N2889.1°179.7°
C03C02C01N041.8°0.5°
C02C03C05C12177.8°180.0°
C02C03C05C060.5°1.0°
C02C03C05C08179.0°178.4°
C02C03C12C13101.6°65.0°
C02C03C12C1783.2°115.0°
C03C02C01O19174.2°179.2°
C03C02C18N2593.9°180.0°
C03C02C18N2886.5°0.3°
C01N04C06C0510.7°1.1°
C01N04C06C07177.7°178.2°
N04C01C02C18173.9°179.4°
N04C01O19C2023.7°0.3°
C03C05C06N047.3°1.6°
C03C05C06C08178.7°179.3°
C03C05C06C07178.1°177.7°
C03C05C08C10103.6°150.8°
C05C03C12C1376.3°115.0°
C05C03C12C1799.0°65.0°
C05C03C02C18177.4°179.9°
C03C05C08H31135.4°30.3°
C03C05C08H3217.3°88.7°
N04C06C05C07170.9°179.3°
N04C06C05C08174.1°177.7°
N04C06C07C09122.8°130.0°
C06N04C01O19179.9°179.7°
N04C06C07H301.7°9.6°
N04C06C07H29116.2°109.6°
C05C06C07C0965.1°50.7°
C06C05C08C1074.8°29.8°
C06C05C03C12177.4°179.0°
C05C06C07H30173.8°171.1°
C05C06C07H2955.9°69.7°
C06C05C08H3146.1°150.3°
C06C05C08H32164.2°90.7°
C07C06C05C083.2°3.0°
C06C07C09H30121.1°120.4°
C06C07C09H29121.0°120.4°
C06C07C09C1166.1°93.3°
C06C07H30H29116.7°119.2°
C06C07C09H3354.1°26.3°
C06C07C09H34173.7°147.1°
C05C08C10H31121.0°120.5°
C05C08C10H32121.0°120.6°
C05C08C10C1189.8°91.6°
C08C05C03C121.1°1.6°
C05C08C10H36150.4°148.7°
C05C08C10H3530.0°28.2°
C05C08H31H32117.0°119.0°
C07C09C11H33120.2°119.6°
C07C09C11H34120.2°119.5°
C07C09C11C1049.7°33.1°
C09C07H30H29116.7°119.3°
C07C09C11H38171.8°87.0°
C07C09C11H3772.3°153.2°
C07C09H33H34119.3°120.8°
C08C10C11C0959.3°60.7°
C08C10C11H36119.8°119.7°
C08C10C11H35119.8°119.8°
C08C10H36H35120.6°120.6°
C08C10C11H38178.6°179.2°
C08C10C11H3762.8°59.3°
C10C08H31H32117.0°118.9°
C09C11C10H38122.1°120.0°
C09C11C10H37122.1°120.0°
C11C09C07H30172.8°146.3°
C11C09C07H2954.9°27.1°
C09C11C10H36179.1°179.5°
C09C11C10H3560.5°59.0°
C09C11H38H37113.2°119.8°
C11C09H33H34119.3°120.8°
C11C10H36H35120.6°120.6°
C10C11H38H37113.1°120.0°
C11C10C08H3131.1°147.9°
C11C10C08H32149.2°29.0°
C10C11C09H3370.5°86.5°
C10C11C09H34169.9°152.6°
C03C12C13C17175.3°180.0°
C03C12C13C14177.9°180.0°
C03C12C17C16177.5°179.4°
C12C03C02C184.6°0.1°
C03C12C13H392.2°0.3°
C03C12C17H432.5°0.3°
C12C13C14H39180.0°179.8°
C12C13C14C151.4°0.2°
C13C12C17C162.4°0.6°
C13C12C17H43177.6°179.7°
C12C13C14H40178.6°179.7°
C13C14C15H40180.0°179.9°
C13C14C15C165.4°0.1°
C14C13C12C172.6°0.0°
C13C14C15H41174.6°179.4°
C14C15C16H41180.0°179.4°
C14C15C16C175.4°0.6°
C15C14C13H39178.6°180.0°
C14C15C16H42174.6°179.4°
C15C16C17C121.8°0.9°
C15C16C17H42180.0°180.0°
C15C16C17H43178.2°180.0°
C16C15C14H40174.6°180.0°
C12C17C16H43180.0°179.1°
C17C12C13H39177.4°179.7°
C12C17C16H42178.2°179.1°
C17C16C15H41174.6°180.0°
C18C02C01O191.5°0.9°
C02C18N25N28179.6°179.7°
C02C18N25N26176.8°179.9°
C02C18N28N27175.9°179.9°
C02C18N25H513.2°0.1°
C01O19C20C21115.7°91.4°
C01O19C20C24132.3°155.7°
C01O19C20H448.1°32.2°
O19C20C21C24109.3°118.2°
O19C20C21H44124.6°123.6°
O19C20C21O2275.5°139.5°
O19C20C24H44124.3°123.6°
O19C20C24C2376.9°152.4°
O19C20C21H4543.4°20.0°
O19C20C21H46165.5°101.0°
O19C20C24H50164.3°89.7°
O19C20C24H4942.0°34.5°
C20C21O22H45119.0°119.5°
C20C21O22H46118.9°119.5°
C20C21O22C2319.9°1.7°
C21C20C24H44125.6°118.2°
C21C20C24C2333.2°34.2°
C20C21H45H46123.0°121.0°
C21C20C24H5085.6°152.1°
C21C20C24H49152.0°83.7°
O22C21C20C2433.8°21.4°
C21O22C23C240.1°24.5°
O22C21C20H44159.9°96.8°
O22C21H45H46123.0°120.9°
C21O22C23H48119.8°94.4°
C21O22C23H47119.6°143.3°
O22C23C24C2020.4°36.5°
O22C23C24H48119.6°118.9°
O22C23C24H47119.7°119.0°
C23O22C21H45138.9°121.3°
C23O22C21H4699.0°117.8°
O22C23H48H47121.0°122.3°
O22C23C24H5098.4°154.4°
O22C23C24H49139.2°81.4°
C20C24C23H50118.8°117.9°
C20C24C23H49118.8°117.9°
C24C20C21H45152.8°98.2°
C24C20C21H4685.2°140.9°
C20C24C23H4899.3°82.5°
C20C24C23H47140.1°155.5°
C20C24H50H49123.3°124.2°
C23C24C20H44158.8°84.1°
C24C23H48H47121.0°122.0°
C23C24H50H49123.4°124.2°
C18N25N26H51180.0°180.0°
C18N25N26N270.8°0.0°
N25C18N28N273.7°0.4°
N26N25C18N282.8°0.2°
N25N26N27N281.3°0.3°
N26N27N28C183.1°0.4°
N27N26N25H51179.2°180.0°
N28C18N25H51177.2°179.8°
H30C07C09H3366.9°94.1°
H30C07C09H3452.6°26.8°
H29C07C09H33175.2°146.7°
H29C07C09H3465.3°92.5°
H36C10C11H3858.8°59.5°
H36C10C11H3757.0°60.5°
H36C10C08H3188.7°28.2°
H36C10C08H3229.4°90.7°
H35C10C11H3861.6°61.0°
H35C10C11H37177.4°179.0°
H35C10C08H31150.9°92.3°
H35C10C08H3291.0°148.8°
H38C11C09H3351.6°153.4°
H38C11C09H3468.0°32.6°
H37C11C09H33167.4°33.6°
H37C11C09H3447.9°87.3°
H39C13C14H401.5°0.0°
H41C15C16H425.4°0.0°
H41C15C14H405.4°0.6°
H42C16C17H431.8°0.0°
H44C20C21H4581.1°143.6°
H44C20C21H4641.0°22.7°
H44C20C24H5040.0°33.8°
H44C20C24H4982.4°158.0°
H48C23C24H50141.9°35.4°
H48C23C24H4919.6°159.6°
H47C23C24H5021.2°86.6°
H47C23C24H49101.1°37.6°

246704

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