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R18

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C1C2sing1.52Å1.51Å
C1C10sing1.51Å1.54Å
C1H12Asing1.09Å1.12Å
C1H11Asing1.09Å1.11Å
C2C3sing1.51Å1.50Å
C2H22sing1.09Å1.12Å
C2H21sing1.09Å1.12Å
C3C4sing1.40Å1.44Å
C3O83doub1.22Å1.23Å
C4C5doub1.36Å1.36Å
C4H4sing1.08Å1.10Å
C5C6sing1.51Å1.52Å
C5C10sing1.40Å1.49Å
C6C7sing1.53Å1.51Å
C6H62sing1.09Å1.11Å
C6H61sing1.09Å1.11Å
C7C8sing1.52Å1.54Å
C7H72sing1.09Å1.11Å
C7H71sing1.09Å1.12Å
C8C9sing1.51Å1.54Å
C8C14sing1.52Å1.50Å
C8H8sing1.09Å1.11Å
C9C10doub1.36Å1.37Å
C9C11sing1.42Å1.46Å
C11C12doub1.34Å1.35Å
C11H11sing1.08Å1.10Å
C12C13sing1.49Å1.52Å
C12H12sing1.08Å1.10Å
C13C14sing1.56Å1.53Å
C13C17sing1.52Å1.53Å
C13C18sing1.53Å1.55Å
C14C15sing1.53Å1.54Å
C14H14sing1.09Å1.12Å
C15C16sing1.55Å1.53Å
C15H152sing1.09Å1.11Å
C15H151sing1.09Å1.11Å
C16C17sing1.55Å1.55Å
C16H162sing1.09Å1.11Å
C16H161sing1.09Å1.11Å
C17C27sing1.53Å1.51Å
C17O97sing1.43Å1.43Å
C18H183sing1.09Å1.11Å
C18H182sing1.09Å1.11Å
C18H181sing1.09Å1.12Å
C27H273sing1.09Å1.11Å
C27H272sing1.09Å1.12Å
C27H271sing1.09Å1.12Å
O97H97sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C2C1C10111.4°110.7°
C2C1H12A111.5°109.3°
C2C1H11A111.5°109.3°
C1C2C3109.9°109.8°
C1C2H22112.0°109.4°
C1C2H21112.0°109.5°
C10C1H12A111.5°109.2°
C10C1H11A111.6°109.3°
C1C10C5114.2°120.5°
C1C10C9124.6°118.2°
H12AC1H11A98.9°109.1°
C3C2H22112.1°109.4°
C3C2H21112.0°109.4°
C2C3C4113.4°119.8°
C2C3O83123.8°120.1°
H22C2H2198.3°109.4°
C4C3O83122.7°120.1°
C3C4C5121.6°121.0°
C3C4H4122.0°119.5°
C5C4H4116.4°119.5°
C4C5C6118.6°118.8°
C4C5C10122.8°120.6°
C6C5C10118.6°120.6°
C5C6C7111.3°108.7°
C5C6H62111.5°109.6°
C5C6H61111.5°109.6°
C5C10C9121.2°121.3°
C7C6H62111.5°109.6°
C7C6H61111.5°109.5°
C6C7C8109.1°108.3°
C6C7H72112.3°109.7°
C6C7H71112.3°109.7°
H62C6H6198.9°109.7°
C8C7H72112.3°109.7°
C8C7H71112.3°109.7°
C7C8C9110.2°109.9°
C7C8C14110.5°111.5°
C7C8H8108.4°109.5°
H72C7H7198.1°109.7°
C9C8C14109.8°106.9°
C9C8H8109.1°109.5°
C8C9C10120.1°120.4°
C8C9C11116.2°120.7°
C14C8H8108.9°109.5°
C8C14C13112.5°106.5°
C8C14C15116.9°116.1°
C8C14H14100.3°110.7°
C10C9C11123.6°118.9°
C9C11C12124.0°122.3°
C9C11H11122.5°118.9°
C12C11H11113.6°118.8°
C11C12C13121.4°118.1°
C11C12H12113.2°121.1°
C13C12H12125.5°120.8°
C12C13C14108.3°107.6°
C12C13C17119.9°118.1°
C12C13C18107.1°109.6°
C14C13C1798.5°103.2°
C14C13C18112.0°108.0°
C13C14C15103.9°101.4°
C13C14H14114.1°110.9°
C17C13C18110.8°109.9°
C13C17C16100.6°105.4°
C13C17C27112.0°110.2°
C13C17O97113.9°110.3°
C13C18H183107.0°109.5°
C13C18H182113.1°109.4°
C13C18H181113.1°109.4°
C15C14H14109.5°110.7°
C14C15C16102.0°102.9°
C14C15H152115.1°110.7°
C14C15H151115.1°110.7°
C16C15H152115.1°110.7°
C16C15H151115.0°110.7°
C15C16C17107.6°106.3°
C15C16H162112.9°110.1°
C15C16H161112.9°110.1°
H152C15H15195.4°110.7°
C17C16H162112.9°110.1°
C17C16H161112.9°110.1°
C16C17C27112.2°110.3°
C16C17O97107.8°110.3°
H162C16H16197.6°110.0°
C27C17O97110.1°110.2°
C17C27H273112.0°109.5°
C17C27H272111.3°109.5°
C17C27H271111.3°109.5°
C17O97H97113.9°106.8°
H183C18H182113.2°109.5°
H183C18H181113.1°109.5°
H182C18H18197.3°109.4°
H273C27H272111.2°109.5°
H273C27H271111.2°109.4°
H272C27H27199.0°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C2C1C10H12A125.3°120.4°
C2C1C10H11A125.2°120.4°
C2C1H12AH11A117.4°119.4°
C1C2C3H22125.3°120.1°
C1C2C3H21125.3°120.1°
C1C2H22H21117.9°119.9°
C1C2C3C453.6°39.3°
C1C2C3O83129.8°140.7°
C2C1C10C532.3°32.5°
C2C1C10C9148.8°146.7°
C10C1H12AH11A117.5°119.4°
C10C1C2C357.0°46.7°
C10C1C2H2268.3°73.4°
C10C1C2H21177.7°166.8°
C1C10C5C43.2°4.4°
C1C10C5C6178.0°174.8°
C1C10C5C9179.0°179.2°
C1C10C9C8179.8°175.5°
C1C10C9C112.4°6.8°
H12AC1C2C368.3°167.1°
H12AC1C2H22166.4°47.0°
H12AC1C2H2157.0°72.9°
H12AC1C10C593.0°152.9°
H12AC1C10C986.0°26.3°
H11AC1C2C3177.7°73.6°
H11AC1C2H2257.0°166.3°
H11AC1C2H2152.4°46.4°
H11AC1C10C5157.5°87.9°
H11AC1C10C923.5°92.9°
C3C2H22H21118.0°119.8°
C2C3C4O83176.6°180.0°
C2C3C4C524.8°11.8°
C2C3C4H4155.2°168.2°
H22C2C3C471.7°80.7°
H22C2C3O83104.9°99.3°
H21C2C3C4178.8°159.4°
H21C2C3O834.6°20.6°
C3C4C5H4180.0°180.0°
C3C4C5C6177.8°173.5°
C3C4C5C100.9°7.2°
O83C3C4C5158.5°168.2°
O83C3C4H421.4°11.8°
C4C5C6C10178.8°179.3°
C4C5C6C7153.1°147.6°
C4C5C6H6281.6°27.8°
C4C5C6H6127.9°92.7°
C4C5C10C9177.8°174.8°
H4C4C5C62.2°6.5°
H4C4C5C10179.0°172.8°
C5C6C7H62125.2°119.9°
C5C6C7H61125.2°119.8°
C5C6H62H61117.4°120.4°
C5C6C7C857.2°58.4°
C5C6C7H72177.5°61.3°
C5C6C7H7168.0°178.1°
C6C5C10C90.9°6.0°
C10C5C6C728.0°33.1°
C10C5C6H6297.2°153.0°
C10C5C6H61153.3°86.6°
C5C10C9C81.0°5.3°
C5C10C9C11178.7°172.4°
C7C6H62H61117.5°120.3°
C6C7C8H72125.3°119.7°
C6C7C8H71125.3°119.7°
C6C7H72H71118.3°120.6°
C6C7C8C958.6°58.4°
C6C7C8C14180.0°176.8°
C6C7C8H860.7°61.9°
H62C6C7C868.0°178.2°
H62C6C7H7257.3°58.6°
H62C6C7H71166.7°62.0°
H61C6C7C8177.6°61.4°
H61C6C7H7252.3°179.0°
H61C6C7H7157.2°58.4°
C8C7H72H71118.3°120.6°
C7C8C9C14121.9°121.2°
C7C8C9H8118.9°120.3°
C7C8C14H8118.9°121.3°
C7C8C9C1030.8°32.3°
C7C8C9C11151.2°145.3°
C7C8C14C13179.8°179.6°
C7C8C14C1560.1°68.4°
C7C8C14H1458.1°59.0°
H72C7C8C9176.2°61.3°
H72C7C8C1454.7°57.1°
H72C7C8H864.5°178.4°
H71C7C8C966.7°178.1°
H71C7C8C1454.8°63.5°
H71C7C8H8174.0°57.8°
C9C8C14H8119.3°118.5°
C8C9C10C11177.8°177.7°
C8C9C11C120.9°7.4°
C8C9C11H11179.2°172.6°
C9C8C14C1358.0°59.5°
C9C8C14C15178.2°171.5°
C9C8C14H1463.6°61.2°
C14C8C9C10152.7°153.5°
C14C8C9C1129.3°24.2°
C8C14C13C1256.3°67.9°
C8C14C13C15127.4°121.8°
C8C14C13H14113.4°120.6°
C8C14C13C17178.2°166.6°
C8C14C13C1861.6°50.3°
C8C14C15H14113.1°127.3°
C8C14C15C16156.6°156.8°
C8C14C15H15231.3°84.8°
C8C14C15H15178.2°38.4°
H8C8C9C1088.1°88.0°
H8C8C9C1189.9°94.4°
H8C8C14C1361.3°59.0°
H8C8C14C1558.9°53.0°
H8C8C14H14177.1°179.7°
C10C9C11C12178.8°175.0°
C10C9C11H111.3°5.0°
C9C11C12H11179.9°180.0°
C9C11C12C130.0°0.2°
C9C11C12H12180.0°179.1°
C11C12C13H12180.0°179.3°
C11C12C13C1426.7°37.2°
C11C12C13C17138.5°153.4°
C11C12C13C1894.3°79.9°
H11C11C12C13180.0°179.8°
H11C11C12H120.0°0.9°
C12C13C14C17125.5°125.5°
C12C13C14C18117.9°118.2°
C12C13C17C18125.5°126.6°
C12C13C14C15176.3°170.3°
C12C13C14H1457.1°52.7°
C12C13C17C16164.8°148.0°
C12C13C17C2745.5°29.1°
C12C13C17O9780.3°92.9°
C12C13C18H183180.0°53.0°
C12C13C18H18254.7°173.0°
C12C13C18H18154.7°67.1°
H12C12C13C14153.3°142.0°
H12C12C13C1741.5°25.9°
H12C12C13C1885.7°100.8°
C14C13C17C18117.6°114.9°
C13C14C15H14122.3°117.7°
C13C14C15C1631.9°41.8°
C13C14C15H15293.3°160.2°
C13C14C15H151157.1°76.5°
C14C13C17C1647.8°29.6°
C14C13C17C2771.5°89.4°
C14C13C17O97162.8°148.7°
C14C13C18H18361.3°63.9°
C14C13C18H182173.3°56.1°
C14C13C18H18163.9°176.0°
C17C13C14C1550.7°44.7°
C17C13C14H1468.4°72.9°
C13C17C16C1529.6°3.6°
C13C17C16C27119.2°118.9°
C13C17C16O97119.5°119.1°
C13C17C16H16295.6°122.9°
C13C17C16H161154.8°115.6°
C13C17C27O97127.8°122.0°
C17C13C18H18347.6°175.8°
C17C13C18H18277.7°55.7°
C17C13C18H181172.8°64.2°
C13C17C27H273180.0°178.7°
C13C17C27H27254.7°58.6°
C13C17C27H27154.7°61.4°
C13C17O97H97180.0°178.7°
C18C13C14C1565.9°71.5°
C18C13C14H14175.0°170.8°
C18C13C17C1669.7°85.4°
C18C13C17C27171.0°155.7°
C18C13C17O9745.2°33.7°
C13C18H183H182125.3°120.0°
C13C18H183H181125.2°120.0°
C13C18H182H181119.0°119.9°
C14C15C16H152125.3°118.4°
C14C15C16H151125.2°118.4°
C14C15H152H151121.0°123.2°
C14C15C16C171.1°24.1°
C14C15C16H162126.4°95.2°
C14C15C16H161124.1°143.4°
H14C14C15C1690.3°75.9°
H14C14C15H152144.4°42.5°
H14C14C15H15134.9°165.7°
C16C15H152H151120.9°123.2°
C15C16C17H162125.2°119.2°
C15C16C17H161125.2°119.2°
C15C16H162H161118.8°121.5°
C15C16C17C2789.5°115.3°
C15C16C17O97149.1°122.7°
H152C15C16C17124.1°142.5°
H152C15C16H1621.1°23.2°
H152C15C16H161110.7°98.3°
H151C15C16C17126.4°94.3°
H151C15C16H162108.4°146.4°
H151C15C16H1611.2°25.0°
C17C16H162H161118.8°121.6°
C16C17C27O97120.0°122.0°
C16C17C27H27367.8°62.7°
C16C17C27H27257.5°57.3°
C16C17C27H271166.9°177.3°
C16C17O97H9769.4°62.7°
H162C16C17C27145.2°3.9°
H162C16C17O9723.9°118.0°
H161C16C17C2735.7°125.5°
H161C16C17O9785.7°3.5°
C17C27H273H272125.3°120.0°
C17C27H273H271125.3°120.0°
C17C27H272H271117.2°120.0°
C27C17O97H9753.3°59.3°
O97C17C27H27352.2°59.3°
O97C17C27H272177.5°179.3°
O97C17C27H27173.1°60.7°
H183C18H182H181119.1°120.0°
H273C27H272H271117.1°120.0°

224201

PDB entries from 2024-08-28

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