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ND9

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C17C16sing1.51Å1.52Å
O3C16doub1.21Å1.28Å
C16N3sing1.35Å1.33Å
N3C15sing1.47Å1.47Å
C14C18sing1.53Å1.53Å
C14C13sing1.53Å1.53Å
C14C15sing1.53Å1.52Å
C19C18sing1.53Å1.51Å
C19N2sing1.47Å1.47Å
C12C13sing1.53Å1.51Å
C12N2sing1.47Å1.47Å
C21C20sing1.53Å1.53Å
C21C1sing1.53Å1.52Å
N2C11sing1.35Å1.34Å
C20C4sing1.53Å1.54Å
N1C1sing1.47Å1.49Å
C11O2doub1.21Å1.24Å
C11C4sing1.51Å1.56Å
C1C2sing1.53Å1.52Å
C4O1sing1.43Å1.51Å
C4C3sing1.53Å1.54Å
C2C3sing1.53Å1.53Å
O1C5sing1.36Å1.38Å
C5C6doub1.39Å1.39ÅAromatic
C5C10sing1.39Å1.39ÅAromatic
C6C7sing1.38Å1.39ÅAromatic
C10C9doub1.38Å1.39ÅAromatic
C7C8doub1.38Å1.37ÅAromatic
C9C8sing1.38Å1.38ÅAromatic
C15H1sing1.09Å1.10Å
C15H2sing1.09Å1.10Å
C12H3sing1.09Å1.10Å
C12H4sing1.09Å1.10Å
C10H5sing1.08Å1.08Å
C13H6sing1.09Å1.10Å
C13H7sing1.09Å1.10Å
C14H8sing1.09Å1.10Å
C9H9sing1.08Å1.08Å
C6H10sing1.08Å1.08Å
C7H11sing1.08Å1.08Å
C8H12sing1.08Å1.08Å
C3H13sing1.09Å1.10Å
C3H14sing1.09Å1.10Å
C2H15sing1.09Å1.10Å
C2H16sing1.09Å1.10Å
C1H17sing1.09Å1.10Å
N1H18sing1.01Å1.00Å
N1H19sing1.01Å1.00Å
N3H21sing0.97Å1.00Å
C17H22sing1.09Å1.10Å
C17H23sing1.09Å1.10Å
C17CL1sing1.80Å1.07Å
C18H25sing1.09Å1.10Å
C18H26sing1.09Å1.10Å
C19H27sing1.09Å1.10Å
C19H28sing1.09Å1.10Å
C20H29sing1.09Å1.10Å
C20H30sing1.09Å1.10Å
C21H31sing1.09Å1.10Å
C21H32sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C17C16O3122.0°120.0°
C17C16N3117.2°120.0°
C16C17H22109.6°109.5°
C16C17H23109.5°109.5°
C16C17CL1109.2°109.5°
O3C16N3120.8°120.0°
C16N3C15120.6°120.0°
C16N3H21119.7°120.0°
N3C15C14116.4°109.5°
N3C15H1107.7°109.5°
N3C15H2107.7°109.5°
C15N3H21119.7°120.0°
C18C14C13110.6°109.5°
C18C14C15108.4°109.4°
C14C18C19111.5°109.3°
C18C14H8108.7°109.5°
C14C18H25109.0°109.5°
C14C18H26108.9°109.5°
C13C14C15111.7°109.5°
C14C13C12112.2°109.3°
C14C13H6108.8°109.5°
C14C13H7108.8°109.5°
C13C14H8108.6°109.5°
C14C15H1107.7°109.5°
C14C15H2107.7°109.5°
C15C14H8108.7°109.5°
C18C19N2108.3°108.8°
C19C18H25109.0°109.5°
C19C18H26109.0°109.6°
C18C19H27109.8°109.6°
C18C19H28109.7°109.6°
C19N2C12111.2°118.7°
C19N2C11126.2°120.7°
N2C19H27109.8°109.6°
N2C19H28109.8°109.6°
C13C12N2109.5°108.8°
C13C12H3109.5°109.6°
C13C12H4109.4°109.6°
C12C13H6108.8°109.6°
C12C13H7108.8°109.5°
C12N2C11122.6°120.6°
N2C12H3109.5°109.6°
N2C12H4109.5°109.6°
C20C21C1112.0°109.4°
C21C20C4113.9°109.5°
C21C20H29108.3°109.4°
C21C20H30108.3°109.5°
C20C21H31108.8°109.5°
C20C21H32108.8°109.5°
C21C1N1111.4°109.5°
C21C1C2110.8°109.5°
C21C1H17108.4°109.5°
C1C21H31108.8°109.5°
C1C21H32108.8°109.5°
N2C11O2117.6°120.1°
N2C11C4121.7°120.0°
C20C4C11108.0°109.5°
C20C4O1106.9°109.5°
C20C4C3110.0°109.5°
C4C20H29108.3°109.5°
C4C20H30108.4°109.5°
N1C1C2108.9°109.4°
N1C1H17108.9°109.4°
C1N1H18109.5°111.0°
C1N1H19109.5°111.0°
O2C11C4120.6°120.0°
C11C4O1116.3°109.4°
C11C4C3108.4°109.5°
C1C2C3110.4°109.5°
C1C2H15109.2°109.5°
C1C2H16109.2°109.5°
C2C1H17108.5°109.4°
O1C4C3107.2°109.5°
C4O1C5124.0°117.0°
C4C3C2116.0°109.5°
C4C3H13107.8°109.5°
C4C3H14107.8°109.5°
C2C3H13107.8°109.5°
C2C3H14107.8°109.5°
C3C2H15109.2°109.5°
C3C2H16109.3°109.4°
O1C5C6120.3°120.0°
O1C5C10119.0°120.1°
C6C5C10120.5°119.9°
C5C6C7119.0°119.9°
C5C6H10120.5°120.1°
C5C10C9119.4°119.9°
C5C10H5120.3°120.0°
C6C7C8120.6°120.1°
C7C6H10120.5°120.0°
C6C7H11119.7°120.0°
C10C9C8119.9°120.1°
C9C10H5120.3°120.0°
C10C9H9120.0°120.0°
C7C8C9120.1°120.1°
C8C7H11119.7°120.0°
C7C8H12120.0°120.0°
C8C9H9120.0°120.0°
C9C8H12119.9°120.0°
H1C15H2109.5°109.5°
H3C12H4109.5°109.7°
H6C13H7109.5°109.5°
H13C3H14109.5°109.4°
H15C2H16109.5°109.5°
H18N1H19109.4°111.0°
H22C17H23109.5°109.5°
H22C17CL1109.5°109.5°
H23C17CL1109.6°109.5°
H25C18H26109.5°109.4°
H27C19H28109.4°109.6°
H29C20H30109.5°109.5°
H31C21H32109.5°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C17C16O3N3178.6°179.9°
C17C16N3C15178.8°180.0°
C17C16N3H211.2°0.0°
C16C17H22H23120.1°120.0°
C16C17H22CL1119.7°120.0°
C16C17H23CL1119.7°120.0°
O3C16N3C150.2°0.1°
O3C16N3H21179.8°180.0°
O3C16C17H22119.2°120.0°
O3C16C17H230.9°120.0°
O3C16C17CL1120.9°0.1°
C16N3C15H21180.0°180.0°
C16N3C15C14107.6°180.0°
C16N3C15H1131.4°60.0°
C16N3C15H213.4°60.0°
N3C16C17H2259.4°60.1°
N3C16C17H23179.5°60.0°
N3C16C17CL160.5°180.0°
N3C15C14C1880.8°175.0°
N3C15C14C13157.1°65.0°
N3C15C14H1121.0°120.0°
N3C15C14H2121.0°120.0°
N3C15H1H2116.9°120.0°
N3C15C14H837.2°55.0°
C18C14C13C15120.9°120.0°
C18C14C13H8119.2°120.0°
C18C14C15H8118.0°120.0°
C14C18C19H25120.3°120.0°
C14C18C19H26120.3°120.0°
C14C18C19N258.8°54.7°
C18C14C13C1249.3°61.4°
C18C14C15H140.2°65.0°
C18C14C15H2158.2°55.0°
C18C14C13H671.2°178.6°
C18C14C13H7169.7°58.6°
C14C18H25H26119.1°120.0°
C14C18C19H2761.0°174.5°
C14C18C19H28178.7°65.2°
C13C14C15H8119.9°120.0°
C13C14C18C1951.7°61.4°
C14C13C12H6120.4°119.9°
C14C13C12H7120.4°120.0°
C14C13C12N254.1°54.6°
C13C14C15H182.0°55.0°
C13C14C15H236.1°175.1°
C14C13C12H3174.1°174.4°
C14C13C12H465.9°65.2°
C14C13H6H7118.7°120.1°
C13C14C18H25172.1°178.7°
C13C14C18H2668.6°58.7°
C15C14C18C19174.6°178.6°
C15C14C13C12170.1°178.6°
C14C15H1H2116.9°120.0°
C15C14C13H649.7°58.7°
C15C14C13H769.5°61.4°
C14C15N3H2172.3°0.0°
C15C14C18H2565.1°58.7°
C15C14C18H2654.3°61.3°
C18C19N2H27119.8°119.8°
C18C19N2H28119.8°119.8°
C18C19N2C1264.7°53.7°
C18C19N2C11115.2°126.4°
C19C18C14H867.5°58.7°
C19C18H25H26119.1°120.1°
C18C19H27H28120.5°120.3°
C19N2C12C1362.4°53.6°
C19N2C12C11179.9°179.9°
C19N2C11O2178.0°174.4°
C19N2C11C42.8°5.7°
C19N2C12H3177.6°173.4°
C19N2C12H457.6°66.1°
N2C19C18H25179.1°174.7°
N2C19C18H2661.5°65.3°
N2C19H27H28120.6°120.4°
C13C12N2H3120.0°119.8°
C13C12N2H4120.0°119.8°
C13C12N2C11117.5°126.4°
C13C12H3H4120.0°120.3°
C12C13H6H7118.7°120.1°
C12C13C14H870.0°58.7°
C12N2C11O22.2°5.5°
C12N2C11C4177.0°174.4°
N2C12H3H4120.0°120.4°
N2C12C13H666.3°174.6°
N2C12C13H7174.5°65.3°
C12N2C19H2755.1°173.4°
C12N2C19H28175.5°66.2°
C20C21C1H31120.4°120.0°
C20C21C1H32120.4°120.0°
C21C20C4H29120.6°120.0°
C21C20C4H30120.7°120.0°
C20C21C1N1178.6°180.0°
C21C20C4C1171.1°60.0°
C20C21C1C257.2°60.0°
C21C20C4O1163.0°180.0°
C21C20C4C347.0°60.0°
C20C21C1H1761.7°60.0°
C21C20H29H30118.0°120.0°
C20C21H31H32118.8°120.0°
C1C21C20C453.4°60.0°
C21C1N1C2122.5°120.1°
C21C1N1H17119.4°120.0°
C21C1C2H17118.8°120.1°
C21C1C2C356.0°60.0°
C21C1C2H1564.1°180.0°
C21C1C2H16176.2°60.0°
C21C1N1H18180.0°59.9°
C21C1N1H1960.0°176.0°
C1C21C20H2967.3°180.0°
C1C21C20H30174.1°60.0°
C1C21H31H32118.8°120.0°
N2C11C4C2065.3°73.4°
N2C11O2C4179.2°180.0°
N2C11C4O154.8°46.5°
N2C11C4C3175.6°166.5°
C11N2C12H32.5°6.7°
C11N2C12H4122.5°113.8°
C11N2C19H27125.0°6.7°
C11N2C19H284.6°113.7°
C20C4C11O2115.5°106.6°
C20C4C11O1120.1°120.0°
C20C4C11C3119.1°120.0°
C20C4O1C3117.9°120.0°
C20C4C3C247.8°60.0°
C20C4O1C5165.6°178.8°
C20C4C3H1373.1°180.0°
C20C4C3H14168.7°60.0°
C4C20H29H30118.0°120.0°
C4C20C21H3167.0°180.0°
C4C20C21H32173.8°60.0°
N1C1C2H17118.4°119.9°
N1C1C2C3178.9°180.0°
N1C1C2H1558.7°59.9°
N1C1C2H1661.0°60.1°
C1N1H18H19120.0°124.0°
N1C1C21H3158.2°60.0°
N1C1C21H3261.0°60.0°
O2C11C4O1124.3°133.4°
O2C11C4C33.6°13.4°
C11C4O1C3121.4°120.0°
C11C4C3C270.0°60.0°
C11C4O1C544.9°58.8°
C11C4C3H13169.0°60.0°
C11C4C3H1450.9°180.0°
C11C4C20H29168.3°60.0°
C11C4C20H3049.6°180.0°
C1C2C3C453.2°59.9°
C1C2C3H15120.1°120.1°
C1C2C3H16120.1°120.0°
C1C2C3H1367.7°180.0°
C1C2C3H14174.2°60.0°
C1C2H15H16119.6°120.0°
C2C1N1H1857.5°180.0°
C2C1N1H1962.4°56.0°
C2C1C21H3163.1°180.0°
C2C1C21H32177.6°60.0°
O1C4C3C2163.7°180.0°
C4O1C5C6170.5°175.5°
C4O1C5C105.5°4.0°
O1C4C3H1342.8°60.0°
O1C4C3H1475.4°60.0°
O1C4C20H2942.4°60.0°
O1C4C20H3076.3°60.0°
C4C3C2H13121.0°120.0°
C4C3C2H14120.9°120.0°
C3C4O1C576.5°61.2°
C4C3H13H14117.1°120.0°
C4C3C2H1566.9°180.0°
C4C3C2H16173.4°60.0°
C3C4C20H2973.6°180.0°
C3C4C20H30167.6°60.0°
C2C3H13H14117.0°120.0°
C3C2H15H16119.6°119.9°
C3C2C1H1762.8°60.1°
O1C5C6C10175.9°179.5°
O1C5C6C7179.7°180.0°
O1C5C10C9179.0°179.6°
O1C5C10H51.0°0.2°
O1C5C6H100.3°0.8°
C5C6C7H10180.0°179.2°
C6C5C10C95.1°0.1°
C5C6C7C83.7°0.8°
C6C5C10H5174.9°179.7°
C5C6C7H11176.3°179.3°
C10C5C6C73.8°0.6°
C5C10C9H5180.0°179.8°
C5C10C9C86.2°0.2°
C5C10C9H9173.8°179.7°
C10C5C6H10176.2°179.7°
C6C7C8H11180.0°180.0°
C6C7C8C94.9°0.5°
C6C7C8H12175.1°179.5°
C10C9C8C76.1°0.1°
C10C9C8H9180.0°179.9°
C10C9C8H12173.9°180.0°
C7C8C9H12180.0°180.0°
C7C8C9H9173.9°180.0°
C8C7C6H10176.3°180.0°
C8C9C10H5173.8°180.0°
C9C8C7H11175.1°179.5°
H1C15C14H8158.2°175.0°
H1C15N3H2148.6°120.0°
H2C15C14H883.8°64.9°
H2C15N3H21166.7°120.0°
H3C12C13H653.7°65.6°
H3C12C13H765.5°54.5°
H4C12C13H6173.7°54.8°
H4C12C13H754.5°174.8°
H5C10C9H96.2°0.1°
H6C13C14H8169.6°61.3°
H7C13C14H850.4°178.6°
H8C14C18H2552.9°61.3°
H8C14C18H26172.2°178.7°
H9C9C8H126.1°0.1°
H10C6C7H113.7°0.1°
H11C7C8H124.9°0.5°
H13C3C2H15172.1°59.9°
H13C3C2H1652.4°60.0°
H14C3C2H1554.0°60.0°
H14C3C2H1665.7°180.0°
H15C2C1H17177.1°59.9°
H16C2C1H1757.4°180.0°
H17C1N1H1860.6°60.1°
H17C1N1H19179.4°63.9°
H17C1C21H31177.9°60.0°
H17C1C21H3258.7°180.0°
H22C17H23CL1120.1°120.0°
H25C18C19H2759.3°65.5°
H25C18C19H2861.0°54.8°
H26C18C19H27178.7°54.5°
H26C18C19H2858.4°174.8°
H29C20C21H31172.4°60.0°
H29C20C21H3253.1°60.0°
H30C20C21H3153.7°60.0°
H30C20C21H3265.6°180.0°

222415

PDB entries from 2024-07-10

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