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C28

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C2C1sing1.39Å1.41ÅAromatic
C2C3doub1.38Å1.41ÅAromatic
C2F7sing1.35Å1.33Å
C4C5doub1.38Å1.43ÅAromatic
C4C3sing1.38Å1.42ÅAromatic
C4H4sing1.08Å1.08Å
C5C6sing1.38Å1.44ÅAromatic
C5C8sing1.51Å1.54Å
C6C1doub1.38Å1.42ÅAromatic
C6H6sing1.08Å1.08Å
C1H1sing1.08Å1.08Å
C3H3sing1.08Å1.08Å
C8N9sing1.47Å1.49Å
C8C10sing1.53Å1.57Å
C8H8sing1.09Å1.10Å
N9C11sing1.47Å1.48Å
N9HN9sing1.01Å1.00Å
C10F22sing1.40Å1.36Å
C10F23sing1.40Å1.36Å
C10F24sing1.40Å1.36Å
C11C12sing1.51Å1.55Å
C11C13sing1.53Å1.52Å
C11H11sing1.09Å1.10Å
C12N16sing1.35Å1.37Å
C12O17doub1.21Å1.24Å
C13S14sing1.81Å1.78Å
C13H131sing1.09Å1.10Å
C13H132sing1.09Å1.10Å
S14N15sing1.66Å1.72Å
S14O21doub1.42Å1.46Å
S14O25doub1.42Å1.45Å
N15C26sing1.47Å1.52Å
N15C30sing1.47Å1.51Å
N16C18sing1.47Å1.49Å
N16HN16sing0.97Å1.00Å
C18C19sing1.53Å1.55Å
C18C20sing1.53Å1.51Å
C18C31sing1.53Å1.54Å
C19C20sing1.53Å1.73Å
C19H191sing1.09Å1.10Å
C19H192sing1.09Å1.10Å
C20H201sing1.09Å1.10Å
C20H202sing1.09Å1.10Å
C26C27sing1.53Å1.54Å
C26H261sing1.09Å1.10Å
C26H262sing1.09Å1.10Å
C27O28sing1.43Å1.46Å
C27H271sing1.09Å1.10Å
C27H272sing1.09Å1.10Å
O28C29sing1.43Å1.45Å
C29C30sing1.53Å1.54Å
C29H291sing1.09Å1.10Å
C29H292sing1.09Å1.10Å
C30H301sing1.09Å1.10Å
C30H302sing1.09Å1.10Å
N32C31sing1.47Å1.30Å
N32H321sing1.01Å1.00Å
N32H322sing1.01Å1.00Å
C31H311sing1.09Å1.10Å
C31H312sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C1C2C3121.0°119.9°
C1C2F7119.8°120.0°
C2C1C6119.8°120.0°
C2C1H1120.1°120.0°
C3C2F7119.1°120.1°
C2C3C4119.7°120.0°
C2C3H3120.2°120.0°
C5C4C3121.0°120.0°
C5C4H4119.5°119.9°
C4C5C6118.0°120.0°
C4C5C8119.5°120.0°
C3C4H4119.5°120.0°
C4C3H3120.2°120.0°
C6C5C8122.5°120.0°
C5C6C1120.6°120.1°
C5C6H6119.7°120.0°
C5C8N9111.3°109.5°
C5C8C10111.7°109.4°
C5C8H8107.0°109.5°
C1C6H6119.7°119.9°
C6C1H1120.1°120.1°
N9C8C10110.5°109.5°
N9C8H8108.3°109.5°
C8N9C11118.0°106.7°
C8N9HN9106.7°106.7°
C10C8H8107.9°109.5°
C8C10F22112.3°109.4°
C8C10F23111.9°109.5°
C8C10F24111.5°109.5°
C11N9HN9106.8°106.7°
N9C11C12110.1°109.4°
N9C11C13110.9°109.5°
N9C11H11109.0°109.5°
F22C10F23107.2°109.5°
F22C10F24106.5°109.5°
F23C10F24107.1°109.5°
C12C11C13112.1°109.4°
C12C11H11107.8°109.5°
C11C12N16124.2°120.0°
C11C12O17119.4°120.0°
C13C11H11106.9°109.5°
C11C13S14113.4°109.5°
C11C13H131108.2°109.5°
C11C13H132107.3°109.5°
N16C12O17116.4°120.0°
C12N16C18137.9°120.0°
C12N16HN16111.1°120.0°
S14C13H131108.2°109.5°
S14C13H132107.3°109.5°
C13S14N15104.1°103.2°
C13S14O21109.6°111.6°
C13S14O25106.6°111.6°
H131C13H132112.6°109.4°
N15S14O21107.2°102.8°
N15S14O25106.3°102.8°
S14N15C26118.4°121.3°
S14N15C30119.7°121.3°
O21S14O25121.6°122.1°
C26N15C30113.1°117.4°
N15C26C27108.6°108.2°
N15C26H261109.8°109.7°
N15C26H262110.0°109.7°
N15C30C29107.7°108.4°
N15C30H301110.1°109.9°
N15C30H302110.5°109.4°
C18N16HN16111.1°120.0°
N16C18C19116.8°117.5°
N16C18C20128.9°117.4°
N16C18C31110.2°115.6°
C19C18C2069.1°60.0°
C19C18C31110.2°117.5°
C18C19C2054.3°60.0°
C18C19H191134.3°117.5°
C18C19H192139.1°117.5°
C20C18C31114.4°117.5°
C18C20C1956.6°60.0°
C18C20H201132.8°117.5°
C18C20H202137.8°117.5°
C18C31N32124.9°109.5°
C18C31H311104.6°109.4°
C18C31H312101.0°109.5°
C20C19H191134.3°117.5°
C20C19H192139.1°117.5°
C19C20H201132.8°117.5°
C19C20H202137.8°117.5°
H191C19H19270.2°115.5°
H201C20H20272.2°115.6°
C27C26H261109.8°109.7°
C27C26H262109.9°109.7°
C26C27O28111.3°109.6°
C26C27H271108.9°109.5°
C26C27H272108.5°109.5°
H261C26H262108.8°109.7°
O28C27H271108.9°109.4°
O28C27H272108.5°109.4°
C27O28C29113.3°107.7°
H271C27H272110.9°109.5°
O28C29C30110.8°109.7°
O28C29H291109.0°109.4°
O28C29H292108.7°109.5°
C30C29H291109.0°109.5°
C30C29H292108.7°109.3°
C29C30H301110.1°109.7°
C29C30H302110.5°109.7°
H291C29H292110.5°109.4°
H301C30H302108.1°109.7°
C31N32H321109.5°106.7°
C31N32H322109.4°106.7°
N32C31H311104.6°109.5°
N32C31H312101.0°109.5°
H321N32H322109.5°106.7°
H311C31H312122.6°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C1C2C3F7179.1°179.9°
C1C2C3C41.0°0.0°
C2C1C6C51.1°0.5°
C2C1C6H1180.0°179.8°
C2C1C6H6178.9°180.0°
C1C2C3H3178.9°180.0°
C2C3C4C51.0°0.1°
C2C3C4H3180.0°179.9°
C2C3C4H4179.0°180.0°
C3C2C1C61.1°0.2°
C3C2C1H1178.9°180.0°
F7C2C3C4179.9°179.9°
F7C2C1C6179.9°179.7°
F7C2C1H10.2°0.1°
F7C2C3H30.1°0.0°
C5C4C3H4180.0°179.9°
C4C5C6C8178.8°179.7°
C4C5C6C11.1°0.6°
C4C5C6H6178.9°179.9°
C5C4C3H3178.9°180.0°
C4C5C8N9137.1°140.0°
C4C5C8C1098.9°100.1°
C4C5C8H819.0°19.9°
C3C4C5C61.0°0.4°
C3C4C5C8179.9°180.0°
H4C4C5C6179.0°179.7°
H4C4C5C80.1°0.1°
H4C4C3H31.1°0.1°
C5C6C1H6180.0°179.5°
C5C6C1H1178.9°179.7°
C6C5C8N941.7°39.7°
C6C5C8C1082.3°80.3°
C6C5C8H8159.8°159.7°
C8C5C6C1179.9°179.8°
C8C5C6H60.1°0.3°
C5C8N9C10124.7°119.9°
C5C8N9H8117.4°120.0°
C5C8C10H8117.3°120.0°
C5C8N9C11141.7°155.1°
C5C8N9HN998.3°41.3°
C5C8C10F2260.5°180.0°
C5C8C10F2360.2°60.0°
C5C8C10F24179.9°60.0°
H6C6C1H11.1°0.2°
N9C8C10H8118.2°120.1°
C8N9C11HN9120.0°113.8°
N9C8C10F22175.0°60.0°
N9C8C10F2364.3°179.9°
N9C8C10F2455.6°60.0°
C8N9C11C1258.2°85.0°
C8N9C11C13177.3°155.0°
C8N9C11H1159.8°35.0°
C10C8N9C1193.6°85.0°
C10C8N9HN926.4°161.2°
C8C10F22F23123.3°120.0°
C8C10F22F24122.3°120.0°
C8C10F23F24122.4°120.0°
H8C8N9C1124.3°35.0°
H8C8N9HN9144.4°78.7°
H8C8C10F2256.8°60.0°
H8C8C10F23177.5°60.0°
H8C8C10F2462.6°180.0°
N9C11C12C13123.9°120.0°
N9C11C12H11118.8°120.1°
N9C11C13H11118.7°120.1°
N9C11C12N16131.3°180.0°
N9C11C12O1748.0°0.0°
N9C11C13S1497.3°60.1°
N9C11C13H13122.7°60.0°
N9C11C13H132144.5°180.0°
HN9N9C11C12178.2°28.8°
HN9N9C11C1357.2°91.2°
HN9N9C11H1160.2°148.8°
F22C10F23F24114.0°120.1°
C12C11C13H11117.8°120.0°
C11C12N16O17179.3°180.0°
C12C11C13S14139.3°180.0°
C12C11C13H131100.7°60.0°
C12C11C13H13221.1°60.0°
C11C12N16C18179.2°174.8°
C11C12N16HN160.9°5.1°
C13C11C12N16104.8°60.0°
C13C11C12O1775.9°120.0°
C11C13S14H131120.0°120.1°
C11C13S14H132118.3°120.0°
C11C13H131H132118.4°120.0°
C11C13S14N1588.2°180.0°
C11C13S14O2126.3°70.2°
C11C13S14O25159.7°70.3°
H11C11C12N1612.5°59.9°
H11C11C12O17166.8°120.0°
H11C11C13S1421.5°60.0°
H11C11C13H131141.5°179.9°
H11C11C13H13296.8°59.9°
C12N16C18HN16180.0°179.9°
C12N16C18C1949.9°80.3°
C12N16C18C20133.7°148.9°
C12N16C18C3176.8°65.4°
O17C12N16C180.2°5.2°
O17C12N16HN16179.8°174.8°
S14C13H131H132118.4°120.0°
C13S14N15O21116.2°116.2°
C13S14N15O25112.4°116.1°
C13S14O21O25125.2°135.8°
C13S14N15C2681.0°90.0°
C13S14N15C3064.3°90.3°
H131C13S14N1531.8°59.9°
H131C13S14O21146.3°169.7°
H131C13S14O2580.3°49.8°
H132C13S14N15153.6°60.0°
H132C13S14O2192.0°49.7°
H132C13S14O2541.4°169.7°
N15S14O21O25122.3°114.3°
S14N15C26C30147.5°179.7°
S14N15C26C27156.8°132.9°
S14N15C26H26183.2°107.4°
S14N15C26H26236.5°13.2°
S14N15C30C29155.9°133.0°
S14N15C30H30184.1°13.1°
S14N15C30H30235.2°107.4°
O21S14N15C2635.1°26.2°
O21S14N15C30179.6°153.5°
O25S14N15C26166.6°153.8°
O25S14N15C3048.1°25.8°
N15C26C27H261120.0°119.7°
N15C26C27H262120.4°119.7°
N15C26H261H262120.4°120.6°
N15C26C27O2853.6°55.8°
N15C26C27H27166.5°175.9°
N15C26C27H272172.8°64.2°
C26N15C30C2957.1°46.7°
C26N15C30H30162.9°166.6°
C26N15C30H302177.8°72.9°
C30N15C26C2755.7°46.8°
C30N15C26H26164.3°72.9°
C30N15C26H262176.0°166.5°
N15C30C29O2856.9°55.6°
N15C30C29H301120.0°120.0°
N15C30C29H302120.7°119.4°
N15C30C29H29163.1°175.8°
N15C30C29H292176.4°64.4°
N15C30H301H302120.7°120.3°
N16C18C19C20124.0°107.4°
N16C18C19C31126.6°145.0°
N16C18C20C31148.4°145.0°
N16C18C19H1914.0°145.0°
N16C18C19H192109.7°0.0°
N16C18C20H201131.9°0.0°
N16C18C20H20218.3°145.1°
N16C18C31N32179.3°81.4°
N16C18C31H31160.7°158.6°
N16C18C31H31267.4°38.6°
HN16N16C18C19130.1°99.7°
HN16N16C18C2046.3°31.1°
HN16N16C18C31103.2°114.5°
C19C18C20C31103.4°107.5°
C18C19C20H191120.0°107.4°
C18C19C20H192126.2°107.5°
C18C19H191H192140.4°145.7°
C19C18C20H201120.0°107.5°
C19C18C20H202126.5°107.5°
C19C18C31N3249.0°132.9°
C19C18C31H311169.1°12.9°
C19C18C31H31262.8°107.1°
C18C20H201H202139.7°145.7°
C20C18C31N3226.4°64.2°
C20C18C31H31193.6°55.8°
C20C18C31H312138.3°175.8°
C31C18C19H191130.7°0.0°
C31C18C19H19216.9°145.0°
C31C18C20H20116.6°145.0°
C31C18C20H202130.1°0.1°
C18C31N32H311120.0°120.0°
C18C31N32H312111.9°120.0°
C18C31N32H32146.1°174.4°
C18C31N32H32273.8°71.8°
C18C31H311H312113.6°120.0°
C20C19H191H192140.4°145.7°
C19C20H201H202139.7°145.6°
H191C19C20H201120.1°145.0°
H191C19C20H2026.4°0.0°
H192C19C20H2016.3°0.0°
H192C19C20H202107.4°145.0°
C27C26H261H262120.3°120.6°
C26C27O28H271120.0°120.0°
C26C27O28H272119.2°120.0°
C26C27H271H272119.2°120.0°
C26C27O28C2957.4°68.7°
H261C26C27O2866.5°63.8°
H261C26C27H271173.5°56.2°
H261C26C27H27252.8°176.2°
H262C26C27O28173.9°175.5°
H262C26C27H27153.9°64.5°
H262C26C27H27266.8°55.5°
O28C27H271H272119.3°119.9°
C27O28C29C3059.1°68.6°
C27O28C29H29160.9°171.2°
C27O28C29H292178.6°51.3°
H271C27O28C2962.6°171.2°
H272C27O28C29176.6°51.3°
O28C29C30H291120.0°120.2°
O28C29C30H292119.4°120.0°
O28C29H291H292119.4°119.9°
O28C29C30H30163.1°175.6°
O28C29C30H302177.6°63.8°
C30C29H291H292119.4°119.7°
C29C30H301H302120.7°120.6°
H291C29C30H301176.9°64.2°
H291C29C30H30257.6°56.3°
H292C29C30H30156.3°55.6°
H292C29C30H30262.9°176.2°
C31N32H321H322120.0°113.8°
N32C31H311H312113.6°120.0°
H321N32C31H311166.2°65.6°
H321N32C31H31265.7°54.4°
H322N32C31H31146.2°48.2°
H322N32C31H312174.3°168.2°

223532

PDB entries from 2024-08-07

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