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IF2

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
N01C02sing1.49Å1.43Å
C02C03sing1.54Å1.48Å
C03C04sing1.54Å1.49Å
N01C05sing1.49Å1.41Å
C04C05sing1.54Å1.47Å
C07N08doub1.31Å1.37ÅAromatic
N01C09sing1.40Å1.39Å
N08C09sing1.34Å1.35ÅAromatic
C09N10doub1.31Å1.34ÅAromatic
C07N11sing1.34Å1.34ÅAromatic
N10N11sing1.40Å1.37ÅAromatic
N11C12sing1.46Å1.43Å
C07C13sing1.51Å1.53Å
C06C14sing1.51Å1.53Å
C13C14sing1.53Å1.51Å
C06C15doub1.40Å1.42ÅAromatic
C15N16sing1.31Å1.37ÅAromatic
N16C17doub1.34Å1.41ÅAromatic
C17C18sing1.42Å1.36ÅAromatic
C06N19sing1.31Å1.35ÅAromatic
C18N19doub1.34Å1.42ÅAromatic
C17C20sing1.41Å1.44ÅAromatic
C20C21doub1.36Å1.41ÅAromatic
C21C22sing1.39Å1.39ÅAromatic
C18C23sing1.41Å1.46ÅAromatic
C22C23doub1.36Å1.41ÅAromatic
C15C24sing1.51Å1.54Å
C02H26sing1.09Å1.10Å
C02H25sing1.09Å1.10Å
C04H30sing1.09Å1.10Å
C04H29sing1.09Å1.10Å
C05H31sing1.09Å1.10Å
C05H32sing1.09Å1.10Å
C13H37sing1.09Å1.10Å
C13H36sing1.09Å1.10Å
C20H40sing1.08Å1.08Å
C21H41sing1.08Å1.08Å
C22H42sing1.08Å1.08Å
C23H43sing1.08Å1.08Å
C24H45sing1.09Å1.10Å
C24H46sing1.09Å1.10Å
C24H44sing1.09Å1.10Å
C03H28sing1.09Å1.10Å
C03H27sing1.09Å1.10Å
C12H33sing1.09Å1.10Å
C12H34sing1.09Å1.10Å
C12H35sing1.09Å1.10Å
C14H39sing1.09Å1.10Å
C14H38sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
N01C02C03105.1°104.6°
C02N01C05112.7°104.2°
C02N01C09122.8°111.0°
N01C02H26110.6°110.4°
N01C02H25110.6°110.5°
C02C03C04107.5°105.1°
C03C02H26110.5°110.4°
C03C02H25110.5°110.4°
C02C03H28110.0°110.3°
C02C03H27110.0°110.3°
C03C04C05106.8°105.1°
C03C04H30110.1°110.3°
C03C04H29110.2°110.4°
C04C03H28109.9°110.4°
C04C03H27109.9°110.3°
N01C05C04106.2°104.6°
C05N01C09121.4°111.0°
N01C05H31110.3°110.4°
N01C05H32110.3°110.5°
C05C04H30110.1°110.3°
C05C04H29110.1°110.3°
C04C05H31110.3°110.4°
C04C05H32110.3°110.4°
C07N08C09104.9°109.8°
N08C07N11109.3°108.2°
N08C07C13124.3°125.9°
N01C09N08126.3°125.6°
N01C09N10121.7°125.6°
N08C09N10112.0°108.8°
C09N10N11105.5°106.8°
C07N11N10108.3°106.5°
C07N11C12126.1°126.7°
N11C07C13126.4°125.9°
N10N11C12125.5°126.8°
N11C12H33109.5°109.5°
N11C12H34109.4°109.5°
N11C12H35109.5°109.5°
C07C13C14107.9°109.5°
C07C13H37109.8°109.5°
C07C13H36109.9°109.4°
C06C14C13108.9°109.5°
C14C06C15124.3°119.7°
C14C06N19115.8°119.7°
C06C14H39109.6°109.5°
C06C14H38109.6°109.5°
C14C13H37109.9°109.5°
C14C13H36109.9°109.4°
C13C14H39109.6°109.4°
C13C14H38109.6°109.5°
C06C15N16120.6°120.7°
C15C06N19119.9°120.7°
C06C15C24123.4°119.6°
C15N16C17119.2°119.7°
N16C15C24115.9°119.7°
N16C17C18119.8°119.6°
N16C17C20118.7°121.1°
C17C18N19121.0°119.6°
C18C17C20121.5°119.3°
C17C18C23119.4°119.3°
C06N19C18119.3°119.7°
N19C18C23119.6°121.1°
C17C20C21119.5°119.7°
C17C20H40120.2°120.2°
C20C21C22119.4°120.9°
C21C20H40120.3°120.1°
C20C21H41120.3°119.5°
C21C22C23121.9°121.0°
C22C21H41120.3°119.6°
C21C22H42119.1°119.5°
C18C23C22118.3°119.7°
C18C23H43120.8°120.1°
C23C22H42119.0°119.5°
C22C23H43120.8°120.1°
C15C24H45109.5°109.5°
C15C24H46109.5°109.5°
C15C24H44109.5°109.5°
H26C02H25109.5°110.4°
H30C04H29109.5°110.3°
H31C05H32109.5°110.4°
H37C13H36109.5°109.5°
H45C24H46109.5°109.5°
H45C24H44109.4°109.5°
H46C24H44109.5°109.4°
H28C03H27109.4°110.3°
H33C12H34109.5°109.4°
H33C12H35109.5°109.5°
H34C12H35109.5°109.5°
H39C14H38109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
N01C02C03H26119.3°118.8°
N01C02C03H25119.3°118.9°
N01C02C03C041.2°23.9°
C02N01C05C09160.4°119.5°
C02N01C05C0413.8°39.5°
C02N01C09N08176.6°180.0°
C02N01C09N104.6°0.0°
N01C02H26H25122.0°122.5°
C02N01C05H31105.7°158.2°
C02N01C05H32133.2°79.3°
N01C02C03H28118.5°95.1°
N01C02C03H27120.9°142.8°
C02C03C04H28119.7°118.9°
C02C03C04H27119.7°118.9°
C03C02N01C059.4°39.5°
C02C03C04C056.8°0.0°
C03C02N01C09169.5°159.0°
C03C02H26H25122.0°122.3°
C02C03C04H30112.8°118.9°
C02C03C04H29126.3°118.9°
C02C03H28H27120.9°122.1°
C03C04C05N0112.2°23.9°
C03C04C05H30119.5°118.9°
C03C04C05H29119.6°119.0°
C04C03C02H26120.5°142.6°
C04C03C02H25118.1°95.0°
C03C04H30H29121.3°122.2°
C03C04C05H31107.3°142.6°
C03C04C05H32131.7°95.0°
C04C03H28H27120.9°122.2°
N01C05C04H31119.5°118.7°
N01C05C04H32119.5°118.9°
C05N01C09N0818.2°64.7°
C05N01C09N10163.0°115.4°
C05N01C02H26128.7°158.3°
C05N01C02H25109.9°79.3°
N01C05C04H30107.3°142.8°
N01C05C04H29131.8°95.1°
N01C05H31H32121.5°122.5°
C04C05N01C09174.2°159.0°
C05C04H30H29121.2°122.1°
C04C05H31H32121.6°122.4°
C05C04C03H28126.5°118.9°
C05C04C03H27113.0°118.9°
C07N08C09N01177.7°180.0°
C07N08C09N101.2°0.0°
N08C07N11C13178.6°179.7°
N08C07N11N102.2°0.0°
N08C07N11C12179.9°180.0°
N08C07C13C1456.7°90.0°
N08C07C13H3763.1°150.0°
N08C07C13H36176.5°30.0°
N01C09N08N10178.9°179.9°
N01C09N10N11179.1°180.0°
C09N01C02H2671.2°82.2°
C09N01C02H2550.2°40.2°
C09N01C05H3154.7°82.3°
C09N01C05H3266.3°40.2°
C09N08C07N112.1°0.0°
N08C09N10N110.1°0.0°
C09N08C07C13179.3°179.8°
C09N10N11C071.4°0.0°
C09N10N11C12179.4°179.9°
C07N11N10C12177.9°180.0°
N11C07C13C14124.9°90.3°
N11C07C13H37115.4°29.7°
N11C07C13H365.1°149.7°
C07N11C12H33177.6°90.0°
C07N11C12H3457.6°150.1°
C07N11C12H3562.4°30.0°
N10N11C07C13179.1°179.7°
N10N11C12H330.0°89.9°
N10N11C12H34120.0°30.0°
N10N11C12H35120.0°150.1°
C12N11C07C131.2°0.3°
N11C12H33H34120.0°119.9°
N11C12H33H35120.0°120.0°
N11C12H34H35120.0°120.1°
C07C13C14C06172.0°180.0°
C07C13C14H37119.7°120.0°
C07C13C14H36119.8°120.0°
C07C13H37H36120.7°120.0°
C07C13C14H3968.1°60.0°
C07C13C14H3852.1°60.0°
C06C14C13H39119.9°120.0°
C06C14C13H38119.9°120.0°
C14C06C15N19179.9°179.7°
C14C06C15N16178.5°180.0°
C14C06N19C18179.6°180.0°
C14C06C15C240.4°0.0°
C06C14C13H3768.3°60.0°
C06C14C13H3652.2°60.0°
C06C14H39H38120.3°120.0°
C13C14C06C1594.9°90.0°
C13C14C06N1985.1°89.7°
C14C13H37H36120.7°120.0°
C13C14H39H38120.2°120.0°
C06C15N16C24178.3°180.0°
C06C15N16C172.4°0.0°
C15C06N19C180.5°0.3°
C06C15C24H45178.2°90.0°
C06C15C24H4661.8°150.0°
C06C15C24H4458.3°30.0°
C15C06C14H39145.1°150.0°
C15C06C14H3825.0°30.0°
C15N16C17C181.5°0.3°
N16C15C06N191.4°0.3°
C15N16C17C20179.1°180.0°
N16C15C24H450.0°90.0°
N16C15C24H46120.0°30.0°
N16C15C24H44120.0°150.0°
N16C17C18C20179.4°179.8°
N16C17C18N190.4°0.2°
N16C17C20C21179.9°179.8°
N16C17C18C23179.4°179.8°
C17N16C15C24179.3°180.0°
N16C17C20H400.1°0.2°
C17C18N19C061.4°0.0°
C17C18N19C23179.8°180.0°
C18C17C20C210.5°0.0°
C17C18C23C222.1°0.0°
C18C17C20H40179.5°180.0°
C17C18C23H43177.9°180.0°
C06N19C18C23178.4°180.0°
N19C06C15C24179.5°179.7°
N19C06C14H3934.8°30.3°
N19C06C14H38155.0°150.3°
N19C18C17C20179.0°180.0°
N19C18C23C22178.2°180.0°
N19C18C23H431.8°0.1°
C17C20C21H40180.0°179.9°
C17C20C21C220.7°0.0°
C20C17C18C231.2°0.0°
C17C20C21H41179.3°180.0°
C20C21C22H41180.0°180.0°
C20C21C22C231.7°0.0°
C20C21C22H42178.3°180.0°
C21C22C23C182.3°0.0°
C21C22C23H42180.0°180.0°
C22C21C20H40179.3°180.0°
C21C22C23H43177.7°179.9°
C18C23C22H43180.0°180.0°
C18C23C22H42177.7°180.0°
C23C22C21H41178.4°179.9°
C15C24H45H46120.0°120.0°
C15C24H45H44120.0°120.0°
C15C24H46H44120.0°120.0°
H26C02C03H280.8°23.7°
H26C02C03H27119.8°98.4°
H25C02C03H28122.2°146.1°
H25C02C03H271.6°23.9°
H30C04C05H31133.2°98.5°
H30C04C05H3212.1°23.9°
H30C04C03H286.9°122.2°
H30C04C03H27127.5°0.0°
H29C04C05H3112.3°23.6°
H29C04C05H32108.8°146.0°
H29C04C03H28114.0°0.1°
H29C04C03H276.6°122.2°
H37C13C14H3951.6°60.0°
H37C13C14H38171.8°180.0°
H36C13C14H39172.1°180.0°
H36C13C14H3867.7°60.0°
H40C20C21H410.7°0.1°
H41C21C22H421.6°0.1°
H42C22C23H432.3°0.1°
H45C24H46H44120.0°120.0°
H33C12H34H35120.0°120.0°

223532

PDB entries from 2024-08-07

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