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FTH

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C1N2sing1.47Å1.47Å
C1HC11sing1.09Å1.12Å
C1HC1Asing1.09Å1.11Å
C1HC1Bsing1.09Å1.12Å
N2C3sing1.35Å1.34ÅAromatic
N2C6sing1.37Å1.34ÅAromatic
C3N4doub1.30Å1.33ÅAromatic
C3HC3sing1.08Å1.10Å
N4C5sing1.34Å1.32ÅAromatic
C5C6doub1.35Å1.40ÅAromatic
C5HC5sing1.08Å1.10Å
C6C7sing1.51Å1.55Å
C7C8sing1.53Å1.55Å
C7HC71sing1.09Å1.11Å
C7HC72sing1.09Å1.12Å
C8N9sing1.47Å1.45Å
C8C19sing1.51Å1.58Å
C8HC8sing1.09Å1.11Å
N9C10sing1.47Å1.44Å
N9HN9sing1.01Å1.02Å
C10C11sing1.51Å1.47Å
C10H101sing1.09Å1.11Å
C10H102sing1.09Å1.11Å
C11C12doub1.38Å1.42ÅAromatic
C11C18sing1.38Å1.43ÅAromatic
C12C13sing1.38Å1.43ÅAromatic
C12HC12sing1.08Å1.10Å
C13C14doub1.40Å1.43ÅAromatic
C13HC13sing1.08Å1.10Å
C14C15sing1.43Å1.42Å
C14C17sing1.40Å1.42ÅAromatic
C15N16trip1.14Å1.14Å
C17C18doub1.38Å1.42ÅAromatic
C17HC17sing1.08Å1.10Å
C18HC18sing1.08Å1.10Å
C19O20doub1.21Å1.24Å
C19N21sing1.35Å1.33Å
N21C22sing1.47Å1.40Å
N21C26sing1.47Å1.51Å
C22C23sing1.53Å1.48Å
C22H221sing1.09Å1.11Å
C22H222sing1.09Å1.12Å
C23C24sing1.50Å1.49Å
C23H231sing1.09Å1.11Å
C23H232sing1.09Å1.12Å
C24C25doub1.34Å1.36Å
C24C37sing1.43Å1.46Å
C25C26sing1.50Å1.50Å
C25C27sing1.47Å1.46Å
C26H261sing1.09Å1.11Å
C26H262sing1.09Å1.11Å
C27C28doub1.39Å1.44ÅAromatic
C27C36sing1.46Å1.43ÅAromatic
C28C29sing1.39Å1.42ÅAromatic
C28HC28sing1.08Å1.10Å
C29C30doub1.36Å1.40ÅAromatic
C29HC29sing1.08Å1.10Å
C30C31sing1.40Å1.42ÅAromatic
C30HC30sing1.08Å1.10Å
C31C32doub1.41Å1.42ÅAromatic
C31C36sing1.42Å1.45ÅAromatic
C32C33sing1.36Å1.42ÅAromatic
C32HC32sing1.08Å1.10Å
C33C34doub1.39Å1.42ÅAromatic
C33HC33sing1.08Å1.10Å
C34C35sing1.36Å1.41ÅAromatic
C34HC34sing1.08Å1.10Å
C35C36doub1.40Å1.45ÅAromatic
C35HC35sing1.08Å1.10Å
C37N38trip1.14Å1.17Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
N2C1HC11127.5°109.4°
N2C1HC1A105.9°109.5°
N2C1HC1B105.9°109.4°
C1N2C3127.5°126.4°
C1N2C6128.1°126.4°
HC11C1HC1A105.9°109.5°
HC11C1HC1B105.8°109.5°
HC1AC1HC1B103.5°109.5°
C3N2C6104.3°107.2°
N2C3N4113.3°108.7°
N2C3HC3123.6°125.7°
N2C6C5108.3°106.8°
N2C6C7120.7°126.6°
N4C3HC3123.1°125.6°
C3N4C5106.1°109.3°
N4C5C6107.9°108.0°
N4C5HC5123.7°126.0°
C6C5HC5128.4°125.9°
C5C6C7131.0°126.6°
C6C7C8116.6°109.5°
C6C7HC71109.6°109.5°
C6C7HC72109.6°109.4°
C8C7HC71109.6°109.5°
C8C7HC72109.6°109.4°
C7C8N9108.7°109.5°
C7C8C19111.8°109.4°
C7C8HC8110.1°109.4°
HC71C7HC72100.5°109.5°
N9C8C19114.0°109.6°
N9C8HC8107.7°109.5°
C8N9C10116.9°106.7°
C8N9HN9109.5°106.7°
C19C8HC8104.3°109.4°
C8C19O20123.0°119.9°
C8C19N21117.0°120.1°
C10N9HN9109.5°106.7°
N9C10C11112.8°109.5°
N9C10H101110.9°109.5°
N9C10H102111.0°109.5°
C11C10H101111.0°109.4°
C11C10H102111.0°109.5°
C10C11C12119.8°119.9°
C10C11C18119.8°119.9°
H101C10H10299.4°109.4°
C12C11C18120.4°120.3°
C11C12C13119.3°120.2°
C11C12HC12119.9°119.9°
C11C18C17120.5°120.2°
C11C18HC18119.9°119.9°
C13C12HC12120.8°119.9°
C12C13C14119.7°119.9°
C12C13HC13120.2°120.1°
C14C13HC13120.0°120.0°
C13C14C15119.1°120.2°
C13C14C17121.2°119.7°
C15C14C17119.7°120.1°
C14C15N16176.1°179.9°
C14C17C18118.8°119.8°
C14C17HC17120.6°120.1°
C18C17HC17120.6°120.1°
C17C18HC18119.5°119.9°
O20C19N21119.7°120.0°
C19N21C22117.4°121.3°
C19N21C26120.3°121.3°
C22N21C26122.1°117.5°
N21C22C23116.4°108.1°
N21C22H221109.7°109.7°
N21C22H222109.7°109.7°
N21C26C25115.3°109.4°
N21C26H261110.0°109.6°
N21C26H262110.1°109.2°
C23C22H221109.7°109.8°
C23C22H222109.7°109.7°
C22C23C24118.4°110.4°
C22C23H231109.0°109.4°
C22C23H232109.0°109.3°
H221C22H222100.4°109.8°
C24C23H231109.1°109.2°
C24C23H232109.0°109.4°
C23C24C25121.4°124.0°
C23C24C37115.2°118.0°
H231C23H232101.1°109.1°
C25C24C37123.2°118.0°
C24C25C26121.3°123.1°
C24C25C27119.7°118.4°
C24C37N38171.9°180.0°
C26C25C27119.0°118.5°
C25C26H261110.1°109.5°
C25C26H262110.1°109.5°
C25C27C28120.3°120.7°
C25C27C36120.6°120.7°
H261C26H262100.2°109.6°
C28C27C36119.1°118.6°
C27C28C29120.5°120.5°
C27C28HC28120.2°119.8°
C27C36C31118.9°118.9°
C27C36C35122.0°121.5°
C29C28HC28119.4°119.7°
C28C29C30121.1°121.9°
C28C29HC29120.2°119.0°
C30C29HC29118.7°119.1°
C29C30C31119.4°120.7°
C29C30HC30119.7°119.6°
C31C30HC30120.9°119.6°
C30C31C32119.0°121.3°
C30C31C36121.0°119.4°
C32C31C36119.9°119.3°
C31C32C33119.9°119.6°
C31C32HC32120.0°120.2°
C31C36C35119.0°119.6°
C33C32HC32120.2°120.2°
C32C33C34120.9°121.0°
C32C33HC33119.7°119.5°
C34C33HC33119.4°119.5°
C33C34C35120.3°120.9°
C33C34HC34120.2°119.5°
C35C34HC34119.5°119.6°
C34C35C36120.0°119.6°
C34C35HC35118.6°120.2°
C36C35HC35121.4°120.2°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
N2C1HC11HC1A125.3°120.0°
N2C1HC11HC1B125.3°119.9°
N2C1HC1AHC1B111.2°120.0°
C1N2C3C6179.7°179.7°
C1N2C3N4179.9°180.0°
C1N2C3HC30.0°0.0°
C1N2C6C5179.8°179.9°
C1N2C6C70.4°0.3°
HC11C1HC1AHC1B111.1°120.1°
HC11C1N2C3180.0°90.0°
HC11C1N2C60.3°90.4°
HC1AC1N2C354.7°150.0°
HC1AC1N2C6125.6°29.7°
HC1BC1N2C354.8°29.9°
HC1BC1N2C6124.9°149.7°
N2C3N4HC3180.0°180.0°
N2C3N4C50.2°0.0°
C3N2C6C50.1°0.4°
C3N2C6C7179.9°180.0°
C6N2C3N40.2°0.3°
C6N2C3HC3179.8°179.7°
N2C6C5N40.0°0.4°
N2C6C5C7179.7°179.6°
N2C6C5HC5180.0°179.8°
N2C6C7C8163.1°90.6°
N2C6C7HC7171.6°29.5°
N2C6C7HC7237.8°149.5°
C3N4C5C60.1°0.3°
C3N4C5HC5179.8°180.0°
HC3C3N4C5179.8°180.0°
N4C5C6HC5179.9°179.7°
N4C5C6C7179.8°180.0°
C5C6C7C817.2°89.9°
C5C6C7HC71108.1°150.0°
C5C6C7HC72142.5°30.0°
HC5C5C6C70.3°0.2°
C6C7C8HC71125.3°120.1°
C6C7C8HC72125.3°119.9°
C6C7HC71HC72115.4°119.9°
C6C7C8N968.9°62.0°
C6C7C8C1957.9°177.9°
C6C7C8HC8173.3°58.0°
C8C7HC71HC72115.4°120.0°
C7C8N9C19125.4°120.0°
C7C8N9HC8119.3°120.0°
C7C8C19HC8119.0°119.9°
C7C8N9C10105.3°90.0°
C7C8N9HN920.0°156.2°
C7C8C19O204.4°93.6°
C7C8C19N21178.7°86.4°
HC71C7C8N956.4°178.0°
HC71C7C8C19176.8°57.9°
HC71C7C8HC861.4°62.0°
HC72C7C8N9165.8°57.9°
HC72C7C8C1967.4°62.1°
HC72C7C8HC848.1°177.9°
N9C8C19HC8117.3°120.0°
C8N9C10HN9125.3°113.8°
C8N9C10C11155.4°180.0°
C8N9C10H10130.1°60.0°
C8N9C10H10279.4°60.0°
N9C8C19O20128.2°26.5°
N9C8C19N2157.5°153.5°
C19C8N9C10129.3°150.0°
C19C8N9HN9105.4°36.2°
C8C19O20N21174.1°180.0°
C8C19N21C22112.6°5.4°
C8C19N21C2664.0°174.9°
HC8C8N9C1014.0°30.0°
HC8C8N9HN9139.3°83.8°
HC8C8C19O20114.6°146.5°
HC8C8C19N2159.7°33.5°
N9C10C11H101125.2°120.0°
N9C10C11H102125.3°120.0°
N9C10H101H102116.9°120.0°
N9C10C11C1299.0°90.1°
N9C10C11C1880.1°90.2°
HN9N9C10C1130.1°66.2°
HN9N9C10H10195.2°173.8°
HN9N9C10H102155.4°53.8°
C11C10H101H102116.9°120.0°
C10C11C12C18179.2°179.7°
C10C11C12C13179.3°179.9°
C10C11C12HC120.7°0.1°
C10C11C18C17179.2°179.8°
C10C11C18HC180.8°0.2°
H101C10C11C12135.7°30.0°
H101C10C11C1845.1°149.7°
H102C10C11C1226.2°149.9°
H102C10C11C18154.6°29.8°
C11C12C13HC12180.0°179.8°
C11C12C13C140.4°0.1°
C11C12C13HC13179.5°179.9°
C12C11C18C170.0°0.5°
C12C11C18HC18180.0°179.9°
C18C11C12C130.1°0.3°
C18C11C12HC12179.9°179.9°
C11C18C17C140.3°0.4°
C11C18C17HC18180.0°179.6°
C11C18C17HC17179.7°179.8°
C12C13C14HC13180.0°180.0°
C12C13C14C15180.0°180.0°
C12C13C14C170.7°0.0°
HC12C12C13C14179.5°179.9°
HC12C12C13HC130.5°0.1°
C13C14C15C17179.3°180.0°
C13C14C15N1686.1°19.9°
C13C14C17C180.6°0.2°
C13C14C17HC17179.3°180.0°
HC13C13C14C150.0°0.0°
HC13C13C14C17179.2°180.0°
C15C14C17C18179.9°179.8°
C15C14C17HC170.1°0.0°
C17C14C15N1693.2°160.1°
C14C17C18HC17180.0°179.8°
C14C17C18HC18179.7°180.0°
HC17C17C18HC180.3°0.2°
O20C19N21C2261.9°174.6°
O20C19N21C26121.5°5.1°
C19N21C22C26176.6°179.8°
C19N21C22C23157.7°117.0°
C19N21C22H22176.9°123.3°
C19N21C22H22232.5°2.6°
C19N21C26C25171.6°136.3°
C19N21C26H26146.3°16.2°
C19N21C26H26263.2°103.9°
N21C22C23H221125.3°119.6°
N21C22C23H222125.3°119.6°
N21C22H221H222115.4°120.6°
N21C22C23C2424.5°46.1°
N21C22C23H231149.8°166.3°
N21C22C23H232100.8°74.3°
C22N21C26C2511.9°43.5°
C22N21C26H261137.2°163.6°
C22N21C26H262113.4°76.4°
C26N21C22C2325.6°62.7°
C26N21C22H22199.7°57.0°
C26N21C22H222150.9°177.6°
N21C26C25C243.7°11.2°
N21C26C25H261125.2°120.2°
N21C26C25H262125.3°119.6°
N21C26C25C27176.5°168.6°
N21C26H261H262115.9°119.8°
C23C22H221H222115.5°120.7°
C22C23C24H231125.3°120.3°
C22C23C24H232125.2°120.3°
C22C23H231H232114.7°119.5°
C22C23C24C2510.1°19.3°
C22C23C24C37165.0°160.7°
H221C22C23C24100.8°73.5°
H221C22C23H23124.5°46.7°
H221C22C23H232133.9°166.1°
H222C22C23C24149.8°165.7°
H222C22C23H23184.9°74.1°
H222C22C23H23224.5°45.4°
C24C23H231H232114.7°119.5°
C23C24C25C37174.7°180.0°
C23C24C25C264.1°1.1°
C23C24C25C27176.2°178.6°
C23C24C37N38110.7°173.9°
H231C23C24C25135.3°139.6°
H231C23C24C3739.7°40.4°
H232C23C24C25115.2°101.0°
H232C23C24C3769.7°79.0°
C24C25C26C27179.8°179.8°
C24C25C26H261121.5°131.3°
C24C25C26H262129.0°108.5°
C24C25C27C2874.0°90.0°
C24C25C27C36104.3°90.4°
C25C24C37N3874.3°6.1°
C37C24C25C26178.8°178.9°
C37C24C25C271.5°1.3°
C25C26H261H262116.0°120.2°
C26C25C27C28105.7°89.8°
C26C25C27C3675.9°89.9°
C27C25C26H26158.3°48.4°
C27C25C26H26251.3°71.8°
C25C27C28C36178.3°179.6°
C25C27C28C29180.0°179.9°
C25C27C28HC280.0°0.0°
C25C27C36C31179.9°179.8°
C25C27C36C352.9°0.7°
C27C28C29HC28180.0°180.0°
C27C28C29C301.2°0.0°
C27C28C29HC29178.9°179.9°
C28C27C36C311.6°0.6°
C28C27C36C35178.7°179.6°
C36C27C28C291.6°0.3°
C36C27C28HC28178.4°179.7°
C27C36C31C301.2°0.6°
C27C36C31C32179.0°179.7°
C27C36C31C35177.2°179.0°
C27C36C35C34178.6°179.7°
C27C36C35HC351.3°0.7°
C28C29C30HC29180.0°179.9°
C28C29C30C310.7°0.0°
C28C29C30HC30179.3°180.0°
HC28C28C29C30178.8°180.0°
HC28C28C29HC291.2°0.1°
C29C30C31HC30180.0°180.0°
C29C30C31C32179.5°180.0°
C29C30C31C360.7°0.3°
HC29C29C30C31179.3°180.0°
HC29C29C30HC300.7°0.1°
C30C31C32C36179.8°179.7°
C30C31C32C33179.1°180.0°
C30C31C32HC320.9°0.0°
C30C31C36C35178.4°179.6°
HC30C30C31C320.5°0.1°
HC30C30C31C36179.3°179.7°
C31C32C33HC32180.0°180.0°
C31C32C33C340.1°0.0°
C31C32C33HC33179.9°180.0°
C32C31C36C351.8°0.6°
C36C31C32C331.1°0.3°
C36C31C32HC32178.9°179.7°
C31C36C35C341.5°0.7°
C31C36C35HC35178.5°179.7°
C32C33C34HC33180.0°179.9°
C32C33C34C350.2°0.0°
C32C33C34HC34179.8°180.0°
HC32C32C33C34179.9°180.0°
HC32C32C33HC330.1°0.0°
C33C34C35HC34180.0°180.0°
C33C34C35C360.5°0.4°
C33C34C35HC35179.5°180.0°
HC33C33C34C35179.8°179.9°
HC33C33C34HC340.2°0.1°
C34C35C36HC35180.0°179.7°
HC34C34C35C36179.5°179.7°
HC34C34C35HC350.5°0.0°

218853

PDB entries from 2024-04-24

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