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LN2

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C21C20doub1.38Å1.38ÅAromatic
C21C22sing1.38Å1.39ÅAromatic
C20C19sing1.39Å1.38ÅAromatic
C22C23doub1.40Å1.39ÅAromatic
C19C18doub1.38Å1.39ÅAromatic
C23C18sing1.40Å1.38ÅAromatic
C23C24sing1.48Å1.48Å
C18C17sing1.51Å1.50Å
C24O4doub1.21Å1.22Å
C24N1sing1.34Å1.36Å
C17N1sing1.47Å1.47Å
N1C12sing1.46Å1.46Å
C11C12sing1.53Å1.54Å
C11C10sing1.51Å1.51Å
C12C13sing1.51Å1.53Å
C10C25doub1.38Å1.39ÅAromatic
C10C9sing1.38Å1.39ÅAromatic
C25C26sing1.38Å1.38ÅAromatic
C13O1doub1.21Å1.23Å
C13Nsing1.35Å1.33Å
C9C8doub1.38Å1.38ÅAromatic
C26C7doub1.39Å1.39ÅAromatic
FC5sing1.35Å1.35Å
NC14sing1.46Å1.45Å
C8C7sing1.39Å1.39ÅAromatic
C7C6sing1.48Å1.49Å
C5C6doub1.40Å1.39ÅAromatic
C5C4sing1.39Å1.37ÅAromatic
C6C27sing1.39Å1.40ÅAromatic
C14C15sing1.53Å1.52Å
C14C16sing1.51Å1.52Å
C4C3doub1.38Å1.38ÅAromatic
C16O3doub1.21Å1.31Å
C16O2sing1.34Å1.21Å
C27C2doub1.40Å1.39ÅAromatic
C3C2sing1.40Å1.39ÅAromatic
C2C1sing1.47Å1.49Å
C1Odoub1.21Å1.22Å
C1Csing1.51Å1.50Å
O2H1sing0.97Å0.95Å
C22H2sing1.08Å1.08Å
C21H3sing1.08Å1.08Å
C20H4sing1.08Å1.08Å
C19H5sing1.08Å1.08Å
C17H6sing1.09Å1.10Å
C17H7sing1.09Å1.10Å
C12H8sing1.09Å1.10Å
NH9sing0.97Å1.00Å
C14H10sing1.09Å1.10Å
C15H11sing1.09Å1.10Å
C15H12sing1.09Å1.10Å
C15H13sing1.09Å1.10Å
C11H14sing1.09Å1.10Å
C11H15sing1.09Å1.10Å
C9H16sing1.08Å1.08Å
C8H17sing1.08Å1.08Å
C25H18sing1.08Å1.08Å
C26H19sing1.08Å1.08Å
C4H20sing1.08Å1.08Å
C3H21sing1.08Å1.08Å
C27H22sing1.08Å1.08Å
CH23sing1.09Å1.10Å
CH24sing1.09Å1.10Å
CH25sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C20C21C22120.4°120.3°
C21C20C19120.2°120.2°
C20C21H3119.8°119.8°
C21C20H4119.9°119.9°
C21C22C23119.2°119.9°
C21C22H2120.4°120.1°
C22C21H3119.8°119.9°
C20C19C18119.9°120.0°
C19C20H4119.9°119.9°
C20C19H5120.0°120.0°
C22C23C18120.5°119.4°
C22C23C24130.7°132.4°
C23C22H2120.4°120.1°
C19C18C23119.8°120.3°
C19C18C17130.6°133.3°
C18C19H5120.0°120.0°
C18C23C24108.8°108.3°
C23C18C17109.5°106.4°
C23C24O4128.6°124.9°
C23C24N1106.3°110.2°
C18C17N1102.1°106.2°
C18C17H6111.3°110.0°
C18C17H7111.3°110.1°
O4C24N1125.0°124.9°
C24N1C17113.3°108.8°
C24N1C12122.6°125.6°
C17N1C12124.2°125.6°
N1C17H6111.3°110.3°
N1C17H7111.3°110.0°
N1C12C11112.3°109.5°
N1C12C13107.2°109.5°
N1C12H8109.0°109.5°
C12C11C10115.7°109.5°
C11C12C13112.1°109.5°
C11C12H8108.0°109.5°
C12C11H14107.9°109.4°
C12C11H15107.9°109.5°
C11C10C25120.8°119.8°
C11C10C9121.2°119.9°
C10C11H14107.9°109.5°
C10C11H15107.9°109.5°
C12C13O1121.0°119.9°
C12C13N115.8°120.1°
C13C12H8108.2°109.4°
C25C10C9117.9°120.3°
C10C25C26121.1°120.1°
C10C25H18119.4°120.0°
C10C9C8121.2°120.1°
C10C9H16119.4°119.9°
C25C26C7121.2°119.9°
C26C25H18119.5°119.9°
C25C26H19119.4°120.1°
O1C13N123.2°120.0°
C13NC14121.6°120.1°
C13NH9119.2°120.0°
C9C8C7121.1°119.9°
C8C9H16119.4°120.0°
C9C8H17119.5°120.1°
C26C7C8117.6°119.7°
C26C7C6121.1°120.1°
C7C26H19119.4°120.1°
FC5C6118.9°119.9°
FC5C4118.2°119.9°
NC14C15110.6°109.5°
NC14C16111.4°109.5°
C14NH9119.2°120.0°
NC14H10109.1°109.4°
C8C7C6121.3°120.2°
C7C8H17119.5°120.0°
C7C6C5122.9°120.1°
C7C6C27119.4°120.0°
C6C5C4123.0°120.1°
C5C6C27117.5°119.9°
C5C4C3118.7°120.3°
C5C4H20120.6°119.8°
C6C27C2120.8°119.7°
C6C27H22119.6°120.1°
C15C14C16109.1°109.5°
C15C14H10108.3°109.5°
C14C15H11109.5°109.5°
C14C15H12109.5°109.5°
C14C15H13109.5°109.5°
C14C16O3114.8°120.0°
C14C16O2121.0°120.0°
C16C14H10108.3°109.5°
C4C3C2120.6°120.1°
C3C4H20120.7°119.9°
C4C3H21119.7°120.0°
O3C16O2124.2°119.9°
C16O2H1109.5°117.0°
C27C2C3119.4°119.8°
C27C2C1119.6°120.1°
C2C27H22119.6°120.2°
C3C2C1121.0°120.1°
C2C3H21119.7°119.9°
C2C1O120.2°120.0°
C2C1C119.4°120.0°
OC1C120.4°120.0°
C1CH23109.5°109.5°
C1CH24109.5°109.5°
C1CH25109.5°109.5°
H6C17H7109.5°110.1°
H11C15H12109.5°109.4°
H11C15H13109.4°109.5°
H12C15H13109.5°109.5°
H14C11H15109.5°109.4°
H23CH24109.4°109.4°
H23CH25109.5°109.5°
H24CH25109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C20C21C22H3180.0°179.9°
C21C20C19H4180.0°180.0°
C20C21C22C230.6°0.1°
C21C20C19C180.5°0.0°
C20C21C22H2179.3°179.9°
C21C20C19H5179.5°180.0°
C22C21C20C190.1°0.0°
C21C22C23H2180.0°180.0°
C21C22C23C180.9°0.1°
C21C22C23C24174.9°180.0°
C22C21C20H4179.9°180.0°
C20C19C18H5180.0°180.0°
C20C19C18C230.2°0.0°
C20C19C18C17178.2°180.0°
C19C20C21H3180.0°179.9°
C22C23C18C190.5°0.0°
C22C23C18C24176.6°179.9°
C22C23C18C17179.2°180.0°
C22C23C24O40.5°0.1°
C22C23C24N1177.8°179.8°
C23C22C21H3179.3°180.0°
C19C18C23C17178.7°180.0°
C19C18C23C24176.1°180.0°
C19C18C17N1176.1°179.8°
C18C19C20H4179.5°180.0°
C19C18C17H657.3°60.8°
C19C18C17H765.1°60.8°
C18C23C24O4175.7°180.0°
C18C23C24N11.7°0.3°
C23C18C17N12.4°0.2°
C18C23C22H2179.1°179.9°
C23C18C19H5179.7°180.0°
C23C18C17H6121.2°119.2°
C23C18C17H7116.4°119.2°
C24C23C18C172.6°0.1°
C23C24O4N1176.9°179.7°
C23C24N1C170.1°0.4°
C23C24N1C12178.6°179.7°
C24C23C22H25.2°0.0°
C18C17N1C241.4°0.4°
C18C17N1H6118.8°119.2°
C18C17N1H7118.8°119.1°
C18C17N1C12177.1°179.7°
C17C18C19H51.9°0.0°
C18C17H6H7123.4°121.6°
O4C24N1C17177.4°179.9°
O4C24N1C121.1°0.0°
C24N1C17C12178.5°179.9°
C24N1C12C11105.8°60.0°
C24N1C12C13130.7°60.1°
C24N1C17H6120.2°118.9°
C24N1C17H7117.4°119.5°
C24N1C12H813.8°180.0°
C17N1C12C1172.5°120.1°
C17N1C12C1351.0°119.9°
N1C17H6H7123.4°121.5°
C17N1C12H8167.9°0.1°
N1C12C11C13120.8°120.0°
N1C12C11H8120.2°120.0°
N1C12C11C10179.4°65.0°
N1C12C13H8117.5°120.0°
N1C12C13O182.6°0.0°
N1C12C13N97.5°180.0°
C12N1C17H658.3°61.1°
C12N1C17H764.1°60.6°
N1C12C11H1458.5°55.0°
N1C12C11H1559.7°175.0°
C12C11C10H14120.9°120.0°
C12C11C10H15120.9°120.0°
C11C12C13H8118.9°120.0°
C12C11C10C25141.9°90.0°
C12C11C10C941.1°89.7°
C11C12C13O141.1°120.0°
C11C12C13N138.8°59.9°
C12C11H14H15117.2°119.9°
C10C11C12C1359.8°174.9°
C11C10C25C9177.1°179.7°
C11C10C25C26176.0°180.0°
C11C10C9C8175.8°180.0°
C10C11C12H859.2°55.0°
C10C11H14H15117.2°120.0°
C11C10C9H164.2°0.0°
C11C10C25H184.0°0.0°
C12C13O1N179.9°180.0°
C12C13NC14176.7°180.0°
C12C13NH93.3°0.1°
C13C12C11H14179.3°65.0°
C13C12C11H1561.1°54.9°
C10C25C26H18180.0°180.0°
C25C10C9C81.2°0.2°
C10C25C26C70.2°0.0°
C25C10C11H1497.2°30.0°
C25C10C11H1521.0°150.0°
C25C10C9H16178.7°179.7°
C10C25C26H19179.8°180.0°
C9C10C25C261.1°0.3°
C10C9C8H16180.0°180.0°
C10C9C8C70.5°0.0°
C9C10C11H1479.8°150.3°
C9C10C11H15162.0°30.3°
C10C9C8H17179.5°179.9°
C9C10C25H18178.9°179.7°
C25C26C7H19180.0°180.0°
C25C26C7C80.5°0.3°
C25C26C7C6178.6°180.0°
O1C13NC143.2°0.0°
O1C13C12H8160.0°120.0°
O1C13NH9176.7°180.0°
C13NC14H9180.0°179.9°
C13NC14C15152.7°85.0°
C13NC14C1685.9°155.0°
NC13C12H820.0°60.0°
C13NC14H1033.7°35.0°
C9C8C7C260.4°0.3°
C9C8C7H17180.0°179.9°
C9C8C7C6178.4°179.9°
C26C7C8C6178.1°179.8°
C26C7C6C551.0°130.3°
C26C7C6C27123.2°49.8°
C26C7C8H17179.7°179.8°
C7C26C25H18179.8°180.0°
FC5C6C77.7°0.1°
FC5C6C4179.9°179.7°
FC5C6C27178.0°180.0°
FC5C4C3179.3°180.0°
FC5C4H200.7°0.3°
NC14C15C16122.8°120.0°
NC14C15H10119.5°120.0°
NC14C16H10120.0°120.0°
NC14C16O348.5°0.0°
NC14C16O2134.0°180.0°
NC14C15H11180.0°179.9°
NC14C15H1260.0°60.0°
NC14C15H1360.0°60.1°
C8C7C6C5131.0°49.9°
C8C7C6C2754.8°130.0°
C7C8C9H16179.4°180.0°
C8C7C26H19179.5°179.7°
C7C6C5C27174.3°179.9°
C7C6C5C4172.4°179.8°
C7C6C27C2172.8°179.9°
C6C7C8H171.6°0.1°
C6C7C26H191.4°0.1°
C7C6C27H227.2°0.0°
C6C5C4C30.7°0.3°
C5C6C27C21.7°0.0°
C6C5C4H20179.3°180.0°
C5C6C27H22178.3°180.0°
C4C5C6C271.9°0.3°
C5C4C3H20180.0°179.7°
C5C4C3C20.8°0.0°
C5C4C3H21179.2°180.0°
C6C27C2H22180.0°179.9°
C6C27C2C30.3°0.4°
C6C27C2C1179.0°180.0°
C15C14C16H10117.7°120.0°
C15C14C16O373.8°120.0°
C15C14C16O2103.7°60.0°
C15C14NH927.3°95.0°
C14C15H11H12120.0°120.0°
C14C15H11H13120.0°120.0°
C14C15H12H13120.0°120.1°
C14C16O3O2177.4°180.0°
C14C16O2H1177.3°180.0°
C16C14NH994.2°25.0°
C16C14C15H1157.2°60.0°
C16C14C15H12177.2°179.9°
C16C14C15H1362.8°60.0°
C4C3C2C271.0°0.4°
C4C3C2H21180.0°180.0°
C4C3C2C1177.7°180.0°
O3C16O2H10.0°0.1°
O3C16C14H10168.5°120.0°
O2C16C14H1014.0°60.0°
C27C2C3C1178.6°179.6°
C27C2C1O10.8°0.4°
C27C2C1C168.2°179.7°
C27C2C3H21179.0°179.6°
C3C2C1O170.6°180.0°
C3C2C1C10.4°0.1°
C2C3C4H20179.2°179.7°
C3C2C27H22179.7°179.7°
C2C1OC179.0°180.0°
C1C2C3H212.3°0.0°
C1C2C27H221.0°0.1°
C2C1CH23179.0°90.0°
C2C1CH2459.0°29.9°
C2C1CH2561.0°150.0°
OC1CH230.0°90.0°
OC1CH24120.0°150.0°
OC1CH25120.0°30.0°
C1CH23H24120.0°120.0°
C1CH23H25120.0°120.0°
C1CH24H25120.0°120.0°
H2C22C21H30.7°0.0°
H3C21C20H40.0°0.1°
H4C20C19H50.6°0.0°
H8C12C11H1461.7°175.1°
H8C12C11H15179.9°65.0°
H9NC14H10146.3°145.1°
H10C14C15H1160.5°60.0°
H10C14C15H1259.5°59.9°
H10C14C15H13179.5°180.0°
H11C15H12H13120.0°120.0°
H16C9C8H170.6°0.1°
H18C25C26H190.2°0.0°
H20C4C3H210.8°0.3°
H23CH24H25120.0°120.0°

222415

PDB entries from 2024-07-10

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