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SN7

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C1C2doub1.36Å1.43ÅAromatic
C1C6sing1.40Å1.41ÅAromatic
C1H1sing1.08Å1.10Å
C2C3sing1.41Å1.40ÅAromatic
C2H2sing1.08Å1.10Å
C3C4doub1.41Å1.41ÅAromatic
C3N7sing1.34Å1.40ÅAromatic
C4C5sing1.40Å1.42ÅAromatic
C4C10sing1.42Å1.43ÅAromatic
C5C6doub1.38Å1.39ÅAromatic
C5H5sing1.08Å1.10Å
C6N36sing1.40Å1.45Å
N7C8doub1.31Å1.40ÅAromatic
N7C35sing1.47Å1.48Å
C8C9sing1.39Å1.40ÅAromatic
C8H8sing1.08Å1.10Å
C9C10doub1.39Å1.39ÅAromatic
C9H9sing1.08Å1.10Å
C10N11sing1.39Å1.38Å
N11C12sing1.39Å1.37Å
N11HN1sing0.97Å1.02Å
C12C13doub1.39Å1.39ÅAromatic
C12C17sing1.39Å1.39ÅAromatic
C13C14sing1.36Å1.39ÅAromatic
C13H13sing1.08Å1.10Å
C14C15doub1.40Å1.42ÅAromatic
C14H14sing1.08Å1.10Å
C15C16sing1.41Å1.43ÅAromatic
C15C18sing1.47Å1.41Å
C16C17doub1.39Å1.38ÅAromatic
C16N37sing1.39Å1.48Å
C17H17sing1.08Å1.10Å
C18O19doub1.22Å1.25Å
C18N20sing1.35Å1.31Å
N20C21sing1.40Å1.31Å
N20HN2sing0.97Å1.02Å
C21C22doub1.39Å1.39ÅAromatic
C21C26sing1.39Å1.42ÅAromatic
C22C23sing1.38Å1.39ÅAromatic
C22H22sing1.08Å1.10Å
C23C24doub1.39Å1.44ÅAromatic
C23H23sing1.08Å1.10Å
C24C25sing1.39Å1.41ÅAromatic
C24N27sing1.40Å1.36Å
C25C26doub1.38Å1.40ÅAromatic
C25H25sing1.08Å1.10Å
C26H26sing1.08Å1.10Å
N27C28sing1.39Å1.35Å
N27HN7sing0.97Å1.02Å
C28C29doub1.39Å1.38ÅAromatic
C28C33sing1.40Å1.40ÅAromatic
C29C30sing1.38Å1.41ÅAromatic
C29H29sing1.08Å1.10Å
C30N31doub1.32Å1.38ÅAromatic
C30H30sing1.08Å1.10Å
N31C32sing1.32Å1.37ÅAromatic
N31C34sing1.46Å1.48Å
C32C33doub1.38Å1.38ÅAromatic
C32H32sing1.08Å1.10Å
C33H33sing1.08Å1.10Å
C34H341sing1.09Å1.11Å
C34H342sing1.09Å1.12Å
C34H343sing1.09Å1.11Å
C35H351sing1.09Å1.11Å
C35H352sing1.09Å1.11Å
C35H353sing1.09Å1.12Å
N36H361sing0.97Å1.02Å
N36H362sing0.97Å1.02Å
N37H371sing0.97Å1.02Å
N37H372sing0.97Å1.02Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C2C1C6120.6°121.0°
C2C1H1120.6°119.5°
C1C2C3122.3°120.0°
C1C2H2120.0°120.0°
C6C1H1118.8°119.5°
C1C6C5115.3°120.5°
C1C6N36128.4°119.8°
C3C2H2117.6°120.0°
C2C3C4117.4°119.3°
C2C3N7123.8°120.8°
C4C3N7118.7°119.9°
C3C4C5118.9°119.8°
C3C4C10121.5°118.9°
C3N7C8120.0°121.7°
C3N7C35125.8°119.2°
C5C4C10119.6°121.3°
C4C5C6125.5°119.4°
C4C5H5118.2°120.2°
C4C10C9118.2°117.9°
C4C10N11120.8°121.1°
C6C5H5116.3°120.3°
C5C6N36116.3°119.7°
C6N36H361128.4°120.0°
C6N36H362105.6°120.0°
C8N7C35114.2°119.1°
N7C8C9121.3°121.9°
N7C8H8119.2°119.1°
N7C35H351125.8°109.5°
N7C35H352106.4°109.5°
N7C35H353106.4°109.5°
C9C8H8119.5°119.1°
C8C9C10120.3°119.6°
C8C9H9120.2°120.1°
C10C9H9119.5°120.2°
C9C10N11121.0°121.0°
C10N11C12135.1°120.0°
C10N11HN1103.4°120.0°
C12N11HN1103.4°120.0°
N11C12C13127.6°119.9°
N11C12C17112.4°119.8°
C13C12C17120.0°120.3°
C12C13C14119.5°120.4°
C12C13H13120.1°119.8°
C12C17C16123.4°119.8°
C12C17H17118.7°120.1°
C14C13H13120.4°119.8°
C13C14C15120.0°120.1°
C13C14H14118.9°120.0°
C15C14H14121.0°119.9°
C14C15C16120.5°119.7°
C14C15C18117.8°120.1°
C16C15C18121.7°120.2°
C15C16C17116.6°119.7°
C15C16N37128.3°120.2°
C15C18O19123.7°120.0°
C15C18N20116.7°120.0°
C17C16N37115.1°120.2°
C16C17H17117.9°120.1°
C16N37H371128.3°120.1°
C16N37H372105.7°120.0°
O19C18N20119.6°120.0°
C18N20C21124.1°120.0°
C18N20HN2117.9°120.0°
C21N20HN2118.1°120.0°
N20C21C22113.0°120.0°
N20C21C26126.4°120.0°
C22C21C26120.6°120.0°
C21C22C23118.1°120.0°
C21C22H22120.7°120.0°
C21C26C25121.5°120.0°
C21C26H26119.8°120.0°
C23C22H22121.1°120.0°
C22C23C24123.0°120.1°
C22C23H23116.8°120.0°
C24C23H23120.3°120.0°
C23C24C25118.0°119.9°
C23C24N27126.4°120.1°
C25C24N27115.6°120.0°
C24C25C26118.9°120.0°
C24C25H25120.7°120.0°
C24N27C28127.2°120.0°
C24N27HN7106.0°120.0°
C26C25H25120.4°120.0°
C25C26H26118.8°120.0°
C28N27HN7106.0°120.0°
N27C28C29116.8°120.9°
N27C28C33126.0°120.9°
C29C28C33117.2°118.2°
C28C29C30119.9°119.1°
C28C29H29119.1°120.5°
C28C33C32123.0°119.1°
C28C33H33119.4°120.5°
C30C29H29121.0°120.5°
C29C30N31121.3°120.9°
C29C30H30120.3°119.6°
N31C30H30118.4°119.6°
C30N31C32119.0°121.9°
C30N31C34123.6°119.1°
C32N31C34117.3°119.0°
N31C32C33119.6°120.8°
N31C32H32120.1°119.6°
N31C34H341123.6°109.5°
N31C34H342107.2°109.4°
N31C34H343107.2°109.5°
C33C32H32120.3°119.5°
C32C33H33117.6°120.5°
H341C34H342107.2°109.5°
H341C34H343107.2°109.5°
H342C34H343102.6°109.4°
H351C35H352106.5°109.5°
H351C35H353106.4°109.4°
H352C35H353103.1°109.5°
H361N36H362105.6°120.0°
H371N37H372105.6°119.9°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C2C1C6H1180.0°180.0°
C1C2C3H2180.0°180.0°
C1C2C3C40.3°0.2°
C1C2C3N7179.2°180.0°
C2C1C6C50.2°0.0°
C2C1C6N36179.4°180.0°
C6C1C2C30.1°0.0°
C6C1C2H2179.9°179.9°
C1C6C5C40.2°0.2°
C1C6C5N36179.6°180.0°
C1C6C5H5179.9°179.9°
C1C6N36H361179.9°0.0°
C1C6N36H36254.7°179.9°
H1C1C2C3179.9°180.0°
H1C1C2H20.1°0.0°
H1C1C6C5179.8°180.0°
H1C1C6N360.7°0.0°
C2C3C4N7179.0°179.8°
C2C3C4C50.6°0.4°
C2C3C4C10178.8°179.7°
C2C3N7C8179.1°180.0°
C2C3N7C351.1°0.0°
H2C2C3C4179.7°179.8°
H2C2C3N70.8°0.1°
C3C4C5C10179.4°179.4°
C3C4C5C60.6°0.3°
C3C4C5H5179.5°179.8°
C4C3N7C80.2°0.2°
C4C3N7C35177.8°179.8°
C3C4C10C91.0°0.4°
C3C4C10N11177.7°179.8°
N7C3C4C5179.6°179.8°
N7C3C4C100.2°0.4°
C3N7C8C35178.2°180.0°
C3N7C8C90.1°0.0°
C3N7C8H8179.9°180.0°
C3N7C35H351180.0°90.0°
C3N7C35H35254.7°30.0°
C3N7C35H35354.8°150.1°
C4C5C6H5180.0°179.9°
C4C5C6N36179.8°179.8°
C5C4C10C9179.7°179.8°
C5C4C10N111.7°0.4°
C10C4C5C6178.8°179.7°
C10C4C5H51.2°0.4°
C4C10C9C81.3°0.2°
C4C10C9N11178.7°179.8°
C4C10C9H9178.7°179.7°
C4C10N11C12173.0°171.5°
C4C10N11HN161.7°8.4°
C5C6N36H3610.5°180.0°
C5C6N36H362124.8°0.1°
H5C5C6N360.3°0.1°
C6N36H361H362125.4°179.9°
N7C8C9H8180.0°180.0°
N7C8C9C100.9°0.1°
N7C8C9H9179.1°180.0°
C8N7C35H3511.8°90.0°
C8N7C35H352127.1°150.0°
C8N7C35H353123.4°29.9°
C35N7C8C9178.3°180.0°
C35N7C8H81.6°0.0°
N7C35H351H352125.3°120.0°
N7C35H351H353125.2°119.9°
N7C35H352H353111.8°120.1°
C8C9C10H9180.0°179.9°
C8C9C10N11177.4°180.0°
H8C8C9C10179.1°180.0°
H8C8C9H90.9°0.1°
C9C10N11C125.6°8.3°
C9C10N11HN1119.7°171.8°
H9C9C10N112.6°0.1°
C10N11C12HN1125.3°180.0°
C10N11C12C138.2°143.1°
C10N11C12C17171.0°36.9°
N11C12C13C17179.2°180.0°
N11C12C13C14179.2°180.0°
N11C12C13H130.8°0.1°
N11C12C17C16179.0°179.8°
N11C12C17H171.0°0.0°
HN1N11C12C13133.5°36.9°
HN1N11C12C1745.7°143.0°
C12C13C14H13180.0°179.9°
C12C13C14C150.6°0.1°
C12C13C14H14179.3°180.0°
C13C12C17C160.3°0.2°
C13C12C17H17179.7°180.0°
C17C12C13C140.1°0.0°
C17C12C13H13180.0°180.0°
C12C17C16C150.0°0.4°
C12C17C16H17180.0°179.8°
C12C17C16N37179.4°180.0°
C13C14C15H14180.0°180.0°
C13C14C15C160.9°0.3°
C13C14C15C18179.7°179.9°
H13C13C14C15179.4°180.0°
H13C13C14H140.6°0.0°
C14C15C16C18179.4°179.8°
C14C15C16C170.5°0.4°
C14C15C16N37178.8°179.9°
C14C15C18O19167.4°173.7°
C14C15C18N2012.9°6.2°
H14C14C15C16179.1°179.8°
H14C14C15C180.3°0.0°
C15C16C17N37179.4°179.6°
C15C16C17H17179.9°179.8°
C16C15C18O1912.0°6.1°
C16C15C18N20167.7°174.0°
C15C16N37H371180.0°167.8°
C15C16N37H37254.7°12.2°
C18C15C16C17179.9°179.8°
C18C15C16N370.6°0.1°
C15C18O19N20179.8°179.9°
C15C18N20C21179.3°177.2°
C15C18N20HN20.7°2.7°
C17C16N37H3710.6°12.6°
C17C16N37H372124.6°167.4°
N37C16C17H170.5°0.2°
C16N37H371H372125.3°180.0°
O19C18N20C210.4°2.7°
O19C18N20HN2179.5°177.3°
C18N20C21HN2179.9°180.0°
C18N20C21C22152.1°143.7°
C18N20C21C2628.9°36.3°
N20C21C22C26179.1°180.0°
N20C21C22C23178.7°180.0°
N20C21C22H221.3°0.0°
N20C21C26C25178.2°179.8°
N20C21C26H261.8°0.0°
HN2N20C21C2227.9°36.3°
HN2N20C21C26151.2°143.7°
C21C22C23H22179.9°179.9°
C21C22C23C240.5°0.1°
C21C22C23H23179.5°179.9°
C22C21C26C250.7°0.2°
C22C21C26H26179.2°180.0°
C26C21C22C230.4°0.1°
C26C21C22H22179.5°180.0°
C21C26C25C240.1°0.5°
C21C26C25H26180.0°179.8°
C21C26C25H25179.9°180.0°
C22C23C24H23180.0°180.0°
C22C23C24C251.1°0.2°
C22C23C24N27179.1°180.0°
H22C22C23C24179.6°180.0°
H22C22C23H230.5°0.0°
C23C24C25N27179.8°179.8°
C23C24C25C260.7°0.5°
C23C24C25H25179.2°180.0°
C23C24N27C287.1°154.6°
C23C24N27HN7132.3°25.4°
H23C23C24C25178.9°179.8°
H23C23C24N270.9°0.0°
C24C25C26H25179.9°179.6°
C24C25C26H26179.8°179.7°
C25C24N27C28173.1°25.6°
C25C24N27HN747.8°154.4°
N27C24C25C26179.4°179.8°
N27C24C25H250.6°0.2°
C24N27C28HN7125.3°180.0°
C24N27C28C29177.8°27.9°
C24N27C28C332.9°152.0°
H25C25C26H260.1°0.2°
N27C28C29C33179.4°180.0°
N27C28C29C30179.7°179.7°
N27C28C29H290.2°0.0°
N27C28C33C32179.5°180.0°
N27C28C33H330.5°0.1°
HN7N27C28C2952.5°152.0°
HN7N27C28C33128.2°28.0°
C28C29C30H29179.9°179.7°
C28C29C30N310.3°0.6°
C28C29C30H30179.7°180.0°
C29C28C33C320.2°0.0°
C29C28C33H33179.8°180.0°
C33C28C29C300.3°0.3°
C33C28C29H29179.6°180.0°
C28C33C32N310.1°0.0°
C28C33C32H33180.0°180.0°
C28C33C32H32179.9°180.0°
C29C30N31H30180.0°179.5°
C29C30N31C320.0°0.6°
C29C30N31C34179.9°179.7°
H29C29C30N31179.6°179.7°
H29C29C30H300.3°0.2°
C30N31C32C34179.9°179.7°
C30N31C32C330.1°0.3°
C30N31C32H32179.8°179.7°
C30N31C34H341180.0°90.3°
C30N31C34H34254.8°29.7°
C30N31C34H34354.8°149.7°
H30C30N31C32180.0°180.0°
H30C30N31C340.1°0.3°
N31C32C33H32180.0°180.0°
N31C32C33H33180.0°180.0°
C32N31C34H3410.1°90.0°
C32N31C34H342125.3°150.0°
C32N31C34H343125.2°30.0°
C34N31C32C33179.8°180.0°
C34N31C32H320.3°0.0°
N31C34H341H342125.2°120.0°
N31C34H341H343125.3°120.1°
N31C34H342H343112.7°120.0°
H32C32C33H330.1°0.0°
H341C34H342H343112.7°120.0°
H351C35H352H353111.8°119.9°

224931

PDB entries from 2024-09-11

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