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5H7

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
OC12doub1.22Å1.23Å
C14C15doub1.39Å1.38ÅAromatic
C14C13sing1.39Å1.39ÅAromatic
C15C16sing1.39Å1.37ÅAromatic
C12C13sing1.48Å1.50Å
C12N2sing1.35Å1.35Å
C13N3doub1.33Å1.34ÅAromatic
C16Fsing1.35Å1.35Å
C16C17doub1.40Å1.40ÅAromatic
C10N1doub1.32Å1.33ÅAromatic
C10C11sing1.39Å1.40ÅAromatic
N1C9sing1.32Å1.33ÅAromatic
N2C11sing1.40Å1.41Å
N3C17sing1.32Å1.34ÅAromatic
C11C7doub1.39Å1.40ÅAromatic
C17C18sing1.48Å1.49Å
C9C8doub1.38Å1.38ÅAromatic
F1C19sing1.35Å1.35Å
C7C8sing1.39Å1.39ÅAromatic
C7C5sing1.51Å1.52Å
C18C19doub1.40Å1.39ÅAromatic
C18C23sing1.40Å1.39ÅAromatic
C19C20sing1.38Å1.37ÅAromatic
F2C23sing1.35Å1.36Å
C5C6sing1.53Å1.53Å
C5C4sing1.53Å1.53Å
C23C22doub1.38Å1.38ÅAromatic
C6C1sing1.53Å1.53Å
C20C21doub1.38Å1.39ÅAromatic
C4C3sing1.53Å1.53Å
C22C21sing1.38Å1.39ÅAromatic
C1Csing1.53Å1.52Å
C1C2sing1.53Å1.52Å
C3C2sing1.53Å1.54Å
C3Nsing1.47Å1.46Å
C1Hsing1.09Å1.10Å
C2H6sing1.09Å1.10Å
C2H7sing1.09Å1.10Å
C3H1sing1.09Å1.10Å
C14H18sing1.08Å1.08Å
C15H19sing1.08Å1.08Å
C20H20sing1.08Å1.08Å
C21H21sing1.08Å1.08Å
C22H22sing1.08Å1.08Å
N2H17sing0.97Å1.00Å
C10H16sing1.08Å1.08Å
C9H15sing1.08Å1.08Å
C8H14sing1.08Å1.08Å
C5H2sing1.09Å1.10Å
C4H11sing1.09Å1.10Å
C4H10sing1.09Å1.10Å
NH8sing1.01Å1.00Å
NH9sing1.01Å1.00Å
C6H12sing1.09Å1.10Å
C6H13sing1.09Å1.10Å
CH5sing1.09Å1.10Å
CH4sing1.09Å1.10Å
CH3sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
OC12C13121.4°120.0°
OC12N2124.6°120.0°
C15C14C13118.2°119.3°
C14C15C16119.0°118.6°
C15C14H18120.9°120.4°
C14C15H19120.5°120.7°
C14C13C12119.9°119.6°
C14C13N3123.0°120.7°
C13C14H18120.9°120.3°
C15C16F119.2°120.4°
C15C16C17119.8°119.2°
C16C15H19120.4°120.7°
C13C12N2113.9°120.0°
C12C13N3116.8°119.7°
C12N2C11129.2°120.0°
C12N2H17115.4°120.0°
C13N3C17118.5°121.6°
FC16C17121.0°120.4°
C16C17N3121.5°120.6°
C16C17C18122.5°119.7°
N1C10C11124.5°120.7°
C10N1C9116.7°121.8°
N1C10H16117.7°119.7°
C10C11N2121.8°120.5°
C10C11C7117.7°119.0°
C11C10H16117.8°119.6°
N1C9C8123.8°120.9°
N1C9H15118.1°119.5°
N2C11C7120.5°120.5°
C11N2H17115.4°120.0°
N3C17C18116.0°119.7°
C11C7C8117.6°118.3°
C11C7C5121.4°120.8°
C17C18C19122.5°120.2°
C17C18C23122.6°120.1°
C9C8C7119.7°119.2°
C8C9H15118.1°119.6°
C9C8H14120.1°120.4°
F1C19C18117.5°120.0°
F1C19C20118.6°120.1°
C8C7C5121.0°120.8°
C7C8H14120.1°120.4°
C7C5C6112.2°109.5°
C7C5C4114.5°109.5°
C7C5H2106.9°109.5°
C19C18C23114.8°119.7°
C18C19C20123.9°119.9°
C18C23F2117.6°120.1°
C18C23C22124.0°119.8°
C19C20C21118.4°120.1°
C19C20H20120.8°120.0°
F2C23C22118.4°120.1°
C6C5C4108.9°109.5°
C5C6C1110.4°109.5°
C6C5H2106.9°109.5°
C5C6H12109.2°109.5°
C5C6H13109.2°109.5°
C5C4C3109.8°109.5°
C4C5H2106.9°109.4°
C5C4H11109.4°109.4°
C5C4H10109.4°109.5°
C23C22C21118.3°120.2°
C23C22H22120.8°119.9°
C6C1C111.1°109.5°
C6C1C2110.1°109.5°
C6C1H108.0°109.5°
C1C6H12109.2°109.5°
C1C6H13109.2°109.5°
C20C21C22120.5°120.3°
C21C20H20120.8°119.9°
C20C21H21119.7°119.8°
C4C3C2107.8°109.5°
C4C3N110.4°109.5°
C4C3H1109.0°109.5°
C3C4H11109.4°109.5°
C3C4H10109.4°109.5°
C22C21H21119.7°119.8°
C21C22H22120.9°119.9°
CC1C2111.4°109.5°
CC1H108.1°109.5°
C1CH5109.5°109.5°
C1CH4109.5°109.5°
C1CH3109.5°109.4°
C1C2C3113.2°109.5°
C2C1H108.1°109.4°
C1C2H6108.5°109.4°
C1C2H7108.6°109.5°
C2C3N110.9°109.5°
C3C2H6108.5°109.5°
C3C2H7108.5°109.5°
C2C3H1108.9°109.5°
NC3H1109.8°109.4°
C3NH8109.5°111.0°
C3NH9109.4°111.0°
H6C2H7109.5°109.5°
H11C4H10109.5°109.5°
H8NH9109.5°111.1°
H12C6H13109.5°109.4°
H5CH4109.4°109.5°
H5CH3109.5°109.4°
H4CH3109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
OC12C13C144.0°0.3°
OC12C13N2177.5°179.9°
OC12C13N3170.4°180.0°
OC12N2C119.8°4.7°
OC12N2H17170.2°175.3°
C15C14C13H18180.0°180.0°
C14C15C16H19180.0°180.0°
C15C14C13C12171.3°180.0°
C15C14C13N32.7°0.3°
C14C15C16F178.6°180.0°
C14C15C16C170.6°0.0°
C13C14C15C161.1°0.0°
C14C13C12N3174.4°179.7°
C14C13C12N2178.5°179.8°
C14C13N3C172.5°0.5°
C13C14C15H19178.9°180.0°
C15C16FC17179.2°180.0°
C15C16C17N30.8°0.2°
C15C16C17C18179.8°180.0°
C16C15C14H18178.9°180.0°
C13C12N2C11167.5°175.3°
C12C13N3C17171.7°179.8°
C12C13C14H188.7°0.0°
C13C12N2H1712.5°4.8°
N2C12C13N37.1°0.0°
C12N2C11C1033.1°33.6°
C12N2C11H17180.0°180.0°
C12N2C11C7148.8°146.1°
C13N3C17C160.7°0.5°
C13N3C17C18178.4°179.7°
N3C13C14H18177.3°179.7°
FC16C17N3178.3°179.8°
FC16C17C180.7°0.0°
FC16C15H191.4°0.0°
C16C17N3C18179.1°179.8°
C16C17C18C1949.0°130.3°
C16C17C18C23128.9°49.9°
C17C16C15H19179.4°180.0°
N1C10C11H16180.0°180.0°
N1C10C11N2178.4°179.8°
N1C10C11C70.3°0.0°
C10N1C9C80.7°0.0°
C10N1C9H15179.3°180.0°
C11C10N1C90.4°0.0°
C10C11N2C7178.1°179.8°
C10C11C7C80.6°0.0°
C10C11C7C5176.5°179.8°
C10C11N2H17146.8°146.4°
N1C9C8H15180.0°179.9°
N1C9C8C70.4°0.0°
C9N1C10H16179.7°179.9°
N1C9C8H14179.6°179.9°
N2C11C7C8178.7°179.8°
N2C11C7C51.7°0.0°
N2C11C10H161.6°0.3°
N3C17C18C19132.0°49.5°
N3C17C18C2350.1°130.3°
C11C7C8C90.3°0.0°
C11C7C8C5177.1°179.8°
C11C7C5C684.9°120.0°
C11C7C5C4150.3°120.0°
C7C11N2H1731.2°33.9°
C7C11C10H16179.7°180.0°
C11C7C8H14179.7°179.9°
C11C7C5H232.0°0.0°
C17C18C19F13.7°0.1°
C17C18C19C23178.0°179.8°
C17C18C19C20176.8°180.0°
C17C18C23F24.6°0.0°
C17C18C23C22176.6°179.8°
C9C8C7H14180.0°179.9°
C9C8C7C5176.8°179.8°
F1C19C18C20179.5°179.9°
F1C19C18C23178.3°179.8°
F1C19C20C21179.4°179.9°
F1C19C20H200.6°0.0°
C8C7C5C692.1°59.8°
C8C7C5C432.8°60.3°
C7C8C9H15179.6°180.0°
C8C7C5H2151.0°179.7°
C7C5C6C4127.9°120.0°
C7C5C6H2116.9°120.0°
C7C5C4H2118.3°120.0°
C7C5C6C1171.6°180.0°
C7C5C4C3170.2°180.0°
C5C7C8H143.2°0.3°
C7C5C4H1150.1°60.0°
C7C5C4H1069.8°60.0°
C7C5C6H1268.2°59.9°
C7C5C6H1351.5°60.0°
C19C18C23F2177.4°179.7°
C19C18C23C221.4°0.5°
C18C19C20C210.1°0.0°
C18C19C20H20179.9°179.9°
C23C18C19C201.2°0.2°
C18C23F2C22178.9°179.8°
C18C23C22C210.5°0.4°
C18C23C22H22179.5°179.7°
C19C20C21H20180.0°179.9°
C19C20C21C221.0°0.1°
C19C20C21H21179.0°179.9°
F2C23C22C21178.3°179.8°
F2C23C22H221.7°0.1°
C6C5C4H2115.2°120.0°
C5C6C1H12120.2°120.1°
C5C6C1H13120.2°120.0°
C6C5C4C363.3°59.9°
C5C6C1C179.5°180.0°
C5C6C1C255.7°60.0°
C5C6C1H62.1°60.0°
C6C5C4H11176.7°60.0°
C6C5C4H1056.8°180.0°
C5C6H12H13119.6°120.0°
C4C5C6C160.5°60.0°
C5C4C3H11120.1°120.0°
C5C4C3H10120.0°120.1°
C5C4C3C260.0°60.0°
C5C4C3N178.7°180.0°
C5C4C3H158.0°60.0°
C5C4H11H10119.8°120.1°
C4C5C6H1259.7°180.0°
C4C5C6H13179.4°60.0°
C23C22C21C200.8°0.2°
C23C22C21H22180.0°179.9°
C23C22C21H21179.2°179.7°
C6C1CC2123.1°120.0°
C6C1CH118.4°120.0°
C6C1C2H117.8°120.0°
C6C1C2C354.7°59.9°
C6C1C2H665.8°60.0°
C6C1C2H7175.3°180.0°
C1C6C5H254.7°60.0°
C1C6H12H13119.6°120.0°
C6C1CH5180.0°60.0°
C6C1CH460.0°60.0°
C6C1CH360.0°180.0°
C20C21C22H21180.0°179.9°
C20C21C22H22179.2°180.0°
C4C3C2C156.5°60.0°
C4C3C2N121.0°120.1°
C4C3C2H1118.0°120.0°
C4C3NH1120.2°120.0°
C4C3C2H664.1°60.0°
C4C3C2H7177.0°180.0°
C3C4C5H251.9°60.0°
C3C4H11H10119.8°120.0°
C4C3NH8180.0°180.0°
C4C3NH960.0°56.0°
C22C21C20H20179.0°180.0°
CC1C2H118.6°120.0°
CC1C2C3178.4°180.0°
CC1C2H657.9°60.0°
CC1C2H761.1°60.0°
CC1C6H1259.4°59.9°
CC1C6H1360.3°60.0°
C1CH5H4120.0°120.0°
C1CH5H3120.0°119.9°
C1CH4H3120.0°120.0°
C1C2C3H6120.6°120.0°
C1C2C3H7120.6°120.0°
C1C2C3N177.5°180.0°
C1C2H6H7118.3°120.0°
C1C2C3H161.6°60.0°
C2C1C6H1264.4°180.0°
C2C1C6H13175.9°60.0°
C2C1CH556.9°60.0°
C2C1CH463.0°180.0°
C2C1CH3176.9°59.9°
C2C3NH1120.4°120.0°
C3C2C1H63.0°60.0°
C3C2H6H7118.3°120.0°
C2C3C4H11179.9°60.0°
C2C3C4H1060.0°180.0°
C2C3NH860.6°59.9°
C2C3NH9179.4°176.0°
NC3C2H656.9°60.0°
NC3C2H762.0°59.9°
NC3C4H1158.6°60.0°
NC3C4H1061.3°59.9°
C3NH8H9120.0°124.0°
HC1C2H6176.4°NaN°
HC1C2H757.5°60.0°
HC1C6H12177.8°60.0°
HC1C6H1358.1°NaN°
HC1CH561.6°180.0°
HC1CH4178.4°60.0°
HC1CH358.4°60.1°
H6C2C3H1177.9°180.0°
H7C2C3H159.0°60.0°
H1C3C4H1162.1°180.0°
H1C3C4H10178.0°60.0°
H1C3NH859.8°60.0°
H1C3NH960.2°64.0°
H18C14C15H191.1°0.0°
H20C20C21H211.0°0.1°
H21C21C22H220.8°0.1°
H15C9C8H140.4°0.1°
H2C5C4H1168.2°180.0°
H2C5C4H10171.9°60.0°
H2C5C6H12174.8°60.0°
H2C5C6H1365.5°180.0°
H5CH4H3120.0°120.0°

223532

PDB entries from 2024-08-07

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