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I5N

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C17C15sing1.51Å1.53Å
C15N14doub1.32Å1.35ÅAromatic
C15C16sing1.38Å1.39ÅAromatic
N14C13sing1.32Å1.35ÅAromatic
C16C11doub1.40Å1.39ÅAromatic
C13C27sing1.51Å1.53Å
C13C12doub1.38Å1.40ÅAromatic
C19C10sing1.53Å1.54Å
C19C18sing1.53Å1.54Å
C11C12sing1.40Å1.40ÅAromatic
C11C2sing1.48Å1.48Å
C10C18sing1.53Å1.55Å
C10C1sing1.51Å1.53Å
C2C1doub1.40Å1.41ÅAromatic
C2C3sing1.39Å1.40ÅAromatic
C1C6sing1.36Å1.40ÅAromatic
C3C4doub1.39Å1.39ÅAromatic
C6C5doub1.40Å1.39ÅAromatic
C4C5sing1.41Å1.38ÅAromatic
C4N7sing1.37Å1.34ÅAromatic
C5C9sing1.46Å1.50ÅAromatic
N7N8sing1.40Å1.35ÅAromatic
C9N8doub1.31Å1.28ÅAromatic
C9N20sing1.40Å1.31Å
N20C21sing1.47Å1.46Å
C25N24sing1.47Å1.48Å
C25C26sing1.53Å1.54Å
N24C23sing1.47Å1.48Å
C23C22sing1.53Å1.55Å
C21C26sing1.53Å1.55Å
C21C22sing1.53Å1.55Å
C26F28sing1.40Å1.36Å
C3H1sing1.08Å1.08Å
C12H2sing1.08Å1.08Å
C16H3sing1.08Å1.08Å
C17H4sing1.09Å1.10Å
C17H5sing1.09Å1.10Å
C17H6sing1.09Å1.10Å
C18H7sing1.09Å1.10Å
C18H8sing1.09Å1.10Å
C19H9sing1.09Å1.10Å
C19H10sing1.09Å1.10Å
C21H11sing1.09Å1.10Å
C22H12sing1.09Å1.10Å
C22H13sing1.09Å1.10Å
C23H14sing1.09Å1.10Å
C23H15sing1.09Å1.10Å
C25H16sing1.09Å1.10Å
C25H17sing1.09Å1.10Å
C26H18sing1.09Å1.10Å
C27H19sing1.09Å1.10Å
C27H20sing1.09Å1.10Å
C27H21sing1.09Å1.10Å
C6H22sing1.08Å1.08Å
N7H23sing0.97Å1.00Å
C10H24sing1.09Å1.10Å
N20H25sing0.97Å1.00Å
N24H26sing1.01Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C17C15N14120.2°119.5°
C17C15C16119.9°119.6°
C15C17H4109.5°109.4°
C15C17H5109.5°109.5°
C15C17H6109.5°109.5°
N14C15C16119.9°120.9°
C15N14C13122.0°122.0°
C15C16C11119.5°119.0°
C15C16H3120.2°120.5°
N14C13C27119.2°119.6°
N14C13C12119.9°120.9°
C16C11C12119.2°118.2°
C16C11C2121.1°120.9°
C11C16H3120.3°120.5°
C27C13C12120.9°119.6°
C13C27H19109.5°109.4°
C13C27H20109.4°109.5°
C13C27H21109.5°109.4°
C13C12C11119.5°119.0°
C13C12H2120.2°120.5°
C10C19C1860.3°60.0°
C19C10C1859.6°60.0°
C19C10C1113.2°117.6°
C10C19H9119.9°117.5°
C10C19H10119.9°117.5°
C19C10H24117.9°117.5°
C19C18C1060.1°60.0°
C19C18H7120.0°117.5°
C19C18H8120.0°117.5°
C18C19H9119.9°117.5°
C18C19H10119.9°117.4°
C12C11C2119.6°120.9°
C11C12H2120.3°120.5°
C11C2C1123.2°119.8°
C11C2C3115.6°119.8°
C18C10C1117.0°117.5°
C10C18H7120.0°117.5°
C10C18H8120.0°117.5°
C18C10H24117.8°117.5°
C10C1C2122.6°119.8°
C10C1C6117.2°119.7°
C1C10H24118.1°115.6°
C1C2C3121.1°120.4°
C2C1C6120.1°120.5°
C2C3C4118.1°119.6°
C2C3H1120.9°120.2°
C1C6C5117.4°120.0°
C1C6H22121.3°120.0°
C3C4C5120.6°119.6°
C3C4N7128.1°133.6°
C4C3H1120.9°120.2°
C6C5C4122.6°120.0°
C6C5C9135.7°133.8°
C5C6H22121.3°120.0°
C5C4N7111.2°106.8°
C4C5C9101.7°106.3°
C4N7N8107.2°109.1°
C4N7H23126.4°125.5°
C5C9N8107.7°107.6°
C5C9N20126.3°126.2°
N7N8C9112.1°110.1°
N8N7H23126.4°125.4°
N8C9N20126.0°126.2°
C9N20C21120.4°120.0°
C9N20H25106.7°120.0°
N20C21C26111.3°109.5°
N20C21C22111.6°109.5°
N20C21H11109.4°109.6°
C21N20H25106.7°120.0°
N24C25C26108.0°109.5°
C25N24C23113.7°111.2°
N24C25H16109.8°109.5°
N24C25H17109.8°109.5°
C25N24H26108.4°111.0°
C25C26C21110.3°109.2°
C25C26F28108.6°109.5°
C26C25H16109.8°109.5°
C26C25H17109.8°109.4°
C25C26H18109.5°109.5°
N24C23C22111.2°109.5°
N24C23H14109.0°109.5°
N24C23H15109.0°109.5°
C23N24H26108.4°111.0°
C23C22C21109.9°109.3°
C23C22H12109.3°109.4°
C23C22H13109.3°109.5°
C22C23H14109.1°109.5°
C22C23H15109.1°109.4°
C26C21C22107.6°109.2°
C21C26F28106.5°109.5°
C26C21H11108.4°109.6°
C21C26H18109.5°109.5°
C22C21H11108.4°109.5°
C21C22H12109.4°109.5°
C21C22H13109.4°109.5°
F28C26H18112.4°109.6°
H4C17H5109.5°109.5°
H4C17H6109.4°109.5°
H5C17H6109.5°109.5°
H7C18H8109.5°115.5°
H9C19H10109.5°115.6°
H12C22H13109.5°109.5°
H14C23H15109.5°109.5°
H16C25H17109.5°109.4°
H19C27H20109.5°109.5°
H19C27H21109.5°109.5°
H20C27H21109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C17C15N14C16179.5°179.0°
C17C15N14C13179.2°180.0°
C17C15C16C11177.8°179.7°
C17C15C16H32.2°1.0°
C15C17H4H5120.0°120.0°
C15C17H4H6120.0°120.0°
C15C17H5H6120.0°120.0°
N14C15C16C112.7°0.6°
C15N14C13C27179.6°179.4°
C15N14C13C120.5°0.7°
N14C15C16H3177.3°180.0°
N14C15C17H40.0°90.1°
N14C15C17H5120.0°150.0°
N14C15C17H6120.0°29.9°
C16C15N14C131.3°1.0°
C15C16C11H3180.0°179.3°
C15C16C11C123.4°0.1°
C15C16C11C2179.5°179.7°
C16C15C17H4179.5°90.9°
C16C15C17H560.5°29.1°
C16C15C17H659.5°149.1°
N14C13C27C12179.8°179.9°
N14C13C12C111.2°0.1°
N14C13C12H2178.9°179.9°
N14C13C27H190.0°90.0°
N14C13C27H20120.0°30.0°
N14C13C27H21120.0°150.0°
C16C11C12C132.6°0.2°
C16C11C12C2176.2°179.8°
C16C11C2C164.0°50.2°
C16C11C2C3120.4°129.7°
C16C11C12H2177.4°179.8°
C27C13C12C11179.0°180.0°
C27C13C12H21.0°0.0°
C13C27H19H20120.0°120.0°
C13C27H19H21120.0°119.9°
C13C27H20H21120.0°120.0°
C13C12C11H2180.0°180.0°
C13C12C11C2178.8°180.0°
C12C13C27H19179.8°90.0°
C12C13C27H2059.8°150.0°
C12C13C27H2160.2°29.9°
C10C19C18H9109.6°107.5°
C10C19C18H10109.6°107.5°
C19C10C18C1102.3°107.5°
C19C10C18H24107.7°107.5°
C19C10C1H24143.7°145.7°
C19C10C1C2119.2°119.7°
C19C10C1C658.9°60.0°
C10C19C18H7109.5°107.5°
C10C19C18H8109.5°107.5°
C10C19H9H10144.6°145.8°
C19C18H7H8144.7°145.7°
C18C19H9H10144.5°145.6°
C12C11C2C1119.9°130.0°
C12C11C2C355.7°50.1°
C12C11C16H3176.6°179.4°
C11C2C1C104.5°0.3°
C11C2C1C3175.4°179.9°
C11C2C1C6177.5°180.0°
C11C2C3C4177.7°180.0°
C11C2C3H12.3°0.0°
C2C11C12H21.2°0.0°
C2C11C16H30.5°0.4°
C18C10C1H24149.9°145.7°
C18C10C1C2174.4°171.7°
C18C10C1C67.5°8.7°
C10C18H7H8144.7°145.6°
C10C1C2C6178.0°179.6°
C10C1C2C3179.9°179.7°
C10C1C6C5179.3°179.7°
C1C10C18H77.2°0.0°
C1C10C18H8148.2°145.0°
C1C10C19H90.8°145.1°
C1C10C19H10141.7°0.1°
C10C1C6H220.7°0.3°
C1C2C3C42.0°0.1°
C2C1C6C51.2°0.1°
C1C2C3H1178.0°180.0°
C2C1C6H22178.8°180.0°
C2C1C10H2424.5°26.0°
C3C2C1C62.1°0.1°
C2C3C4H1180.0°179.9°
C2C3C4C51.0°0.1°
C2C3C4N7178.7°180.0°
C1C6C5H22180.0°180.0°
C1C6C5C40.3°0.0°
C1C6C5C9179.8°180.0°
C6C1C10H24157.5°154.3°
C3C4C5C60.2°0.0°
C3C4C5N7179.7°180.0°
C3C4C5C9179.9°180.0°
C3C4N7N8179.7°180.0°
C3C4N7H230.3°0.0°
C6C5C4C9179.9°180.0°
C6C5C4N7179.6°180.0°
C6C5C9N8179.3°180.0°
C6C5C9N200.5°0.0°
C5C4N7N80.0°0.0°
C4C5C9N80.7°0.0°
C4C5C9N20179.5°180.0°
C5C4C3H1179.0°180.0°
C4C5C6H22179.7°180.0°
C5C4N7H23180.0°180.0°
N7C4C5C90.4°0.0°
C4N7N8H23180.0°180.0°
C4N7N8C90.5°0.0°
N7C4C3H11.4°0.0°
C5C9N8N70.7°0.0°
C5C9N8N20179.8°180.0°
C5C9N20C21161.5°180.0°
C9C5C6H220.2°0.0°
C5C9N20H2577.0°0.0°
N7N8C9N20179.5°180.0°
N8C9N20C2118.7°0.0°
C9N8N7H23179.5°180.0°
N8C9N20H25102.8°180.0°
C9N20C21H25121.5°179.9°
C9N20C21C2678.7°155.0°
C9N20C21C22161.1°85.3°
C9N20C21H1141.1°34.8°
N20C21C26C2561.4°177.5°
N20C21C22C2365.4°177.5°
N20C21C26C22122.6°119.9°
N20C21C26H11120.4°120.2°
N20C21C22H11120.6°120.1°
N20C21C26F28179.0°62.5°
N20C21C22H12174.6°57.6°
N20C21C22H1354.7°62.5°
N20C21C26H1859.2°57.6°
N24C25C26H16119.8°120.1°
N24C25C26H17119.7°120.0°
C25N24C23H26120.6°124.1°
C25N24C23C2256.8°61.7°
N24C25C26C2161.1°59.2°
N24C25C26F2855.2°179.1°
C25N24C23H14177.1°178.3°
C25N24C23H1563.5°58.2°
N24C25H16H17120.6°120.0°
N24C25C26H18178.3°60.7°
C26C25N24C2358.9°61.8°
C25C26C21F28117.6°120.0°
C25C26C21H18120.6°119.9°
C25C26C21C2261.1°57.7°
C25C26F28H18121.3°120.1°
C25C26C21H11178.1°62.3°
C26C25H16H17120.7°119.9°
C26C25N24H2661.8°174.1°
N24C23C22H14120.3°120.0°
N24C23C22H15120.2°120.0°
N24C23C22C2154.9°59.1°
N24C23C22H1265.1°60.8°
N24C23C22H13175.0°179.2°
N24C23H14H15119.2°120.0°
C23N24C25H1660.9°58.3°
C23N24C25H17178.6°178.2°
C23C22C21C2657.0°57.7°
C23C22C21H12120.0°119.9°
C23C22C21H13120.1°120.0°
C23C22C21H11174.1°62.3°
C23C22H12H13119.8°120.1°
C22C23H14H15119.2°120.0°
C22C23N24H2663.8°174.2°
C26C21C22H11117.0°120.0°
C21C26F28H18119.9°120.1°
C26C21C22H1263.0°62.2°
C26C21C22H13177.1°177.7°
C21C26C25H1658.6°60.9°
C21C26C25H17179.2°179.2°
C26C21N20H2542.8°25.0°
C22C21C26F2856.5°177.6°
C21C22H12H13119.8°120.2°
C21C22C23H14175.2°179.1°
C21C22C23H1565.3°60.8°
C22C21C26H18178.3°62.3°
C22C21N20H2577.4°94.6°
F28C26C21H1160.5°57.7°
F28C26C25H16174.9°59.1°
F28C26C25H1764.6°60.9°
H4C17H5H6120.0°120.0°
H7C18C19H90.1°145.0°
H7C18C19H10140.9°0.0°
H7C18C10H24142.9°145.0°
H8C18C19H9140.9°0.0°
H8C18C19H100.1°145.0°
H8C18C10H241.9°0.0°
H9C19C10H24142.9°0.0°
H10C19C10H242.0°145.1°
H11C21C22H1254.0°177.8°
H11C21C22H1365.9°57.7°
H11C21C26H1861.3°177.8°
H11C21N20H25162.7°145.2°
H12C22C23H1455.2°59.2°
H12C22C23H15174.6°179.2°
H13C22C23H1464.7°60.8°
H13C22C23H1554.8°59.2°
H14C23N24H2656.5°54.2°
H15C23N24H26175.9°65.9°
H16C25C26H1862.0°179.2°
H16C25N24H26178.5°65.8°
H17C25C26H1858.5°59.3°
H17C25N24H2658.0°54.1°
H19C27H20H21120.0°120.0°

222624

PDB entries from 2024-07-17

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