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4IF

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C6C7sing1.53Å1.53Å
C6C5sing1.53Å1.53Å
C7C8sing1.53Å1.52Å
C4C5sing1.53Å1.53Å
C4C3sing1.53Å1.53Å
C8C9sing1.53Å1.53Å
C3C2sing1.53Å1.53Å
C9C10sing1.53Å1.52Å
C2C1sing1.51Å1.52Å
C10C11sing1.51Å1.51Å
C1O1doub1.21Å1.25Å
C1O2sing1.34Å1.26Å
C11C12doub1.31Å1.34Å
C16C15sing1.53Å1.52Å
C16C17sing1.53Å1.52Å
C12C13sing1.51Å1.51Å
C15C14sing1.53Å1.52Å
C13C14sing1.53Å1.53Å
C18C17sing1.53Å1.51Å
C18H1sing1.09Å1.10Å
C18H2sing1.09Å1.10Å
C18H3sing1.09Å1.10Å
C4H4sing1.09Å1.10Å
C4H5sing1.09Å1.10Å
C3H6sing1.09Å1.10Å
C3H7sing1.09Å1.10Å
C2H8sing1.09Å1.10Å
C2H9sing1.09Å1.10Å
C5H10sing1.09Å1.10Å
C5H11sing1.09Å1.10Å
C6H12sing1.09Å1.10Å
C6H13sing1.09Å1.10Å
C7H14sing1.09Å1.10Å
C7H15sing1.09Å1.10Å
C12H16sing1.08Å1.08Å
C11H17sing1.08Å1.08Å
C10H18sing1.09Å1.10Å
C10H19sing1.09Å1.10Å
C9H20sing1.09Å1.10Å
C9H21sing1.09Å1.10Å
C8H22sing1.09Å1.10Å
C8H23sing1.09Å1.10Å
C13H24sing1.09Å1.10Å
C13H25sing1.09Å1.10Å
C14H26sing1.09Å1.10Å
C14H27sing1.09Å1.10Å
C15H28sing1.09Å1.10Å
C15H29sing1.09Å1.10Å
O2H30sing0.97Å0.95Å
C16H31sing1.09Å1.10Å
C16H32sing1.09Å1.10Å
C17H33sing1.09Å1.10Å
C17H34sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C7C6C5114.7°109.5°
C6C7C8111.9°109.5°
C7C6H12108.1°109.5°
C7C6H13108.2°109.5°
C6C7H14108.9°109.4°
C6C7H15108.9°109.5°
C6C5C4110.9°109.5°
C6C5H10109.1°109.5°
C6C5H11109.1°109.5°
C5C6H12108.2°109.5°
C5C6H13108.1°109.4°
C7C8C9113.3°109.4°
C8C7H14108.8°109.5°
C8C7H15108.8°109.5°
C7C8H22108.5°109.5°
C7C8H23108.5°109.5°
C5C4C3114.2°109.5°
C5C4H4108.3°109.5°
C5C4H5108.3°109.4°
C4C5H10109.1°109.5°
C4C5H11109.1°109.4°
C4C3C2113.4°109.5°
C3C4H4108.3°109.5°
C3C4H5108.3°109.5°
C4C3H6108.5°109.5°
C4C3H7108.5°109.5°
C8C9C10109.0°109.4°
C8C9H20109.6°109.4°
C8C9H21109.6°109.4°
C9C8H22108.5°109.5°
C9C8H23108.5°109.5°
C3C2C1114.2°109.4°
C2C3H6108.5°109.5°
C2C3H7108.5°109.5°
C3C2H8108.3°109.4°
C3C2H9108.3°109.5°
C9C10C11109.4°109.5°
C9C10H18109.5°109.5°
C9C10H19109.5°109.5°
C10C9H20109.6°109.5°
C10C9H21109.6°109.5°
C2C1O1119.3°120.0°
C2C1O2118.8°120.0°
C1C2H8108.2°109.5°
C1C2H9108.3°109.5°
C10C11C12123.9°120.0°
C10C11H17118.1°120.0°
C11C10H18109.5°109.5°
C11C10H19109.5°109.5°
O1C1O2122.0°120.0°
C1O2H30109.5°117.0°
C11C12C13124.0°120.0°
C11C12H16118.0°120.0°
C12C11H17118.1°120.0°
C15C16C17111.4°109.5°
C16C15C14111.7°109.5°
C16C15H28108.9°109.5°
C16C15H29108.9°109.5°
C15C16H31109.0°109.5°
C15C16H32109.0°109.5°
C16C17C18109.6°109.5°
C17C16H31109.0°109.5°
C17C16H32109.0°109.5°
C16C17H33109.4°109.4°
C16C17H34109.4°109.5°
C12C13C14110.1°109.4°
C13C12H16118.0°120.0°
C12C13H24109.3°109.5°
C12C13H25109.3°109.5°
C15C14C13111.5°109.5°
C15C14H26109.0°109.4°
C15C14H27109.0°109.5°
C14C15H28108.9°109.4°
C14C15H29108.9°109.5°
C14C13H24109.3°109.4°
C14C13H25109.3°109.5°
C13C14H26108.9°109.5°
C13C14H27108.9°109.6°
C17C18H1109.5°109.5°
C17C18H2109.4°109.4°
C17C18H3109.5°109.4°
C18C17H33109.4°109.5°
C18C17H34109.4°109.5°
H1C18H2109.4°109.5°
H1C18H3109.5°109.5°
H2C18H3109.5°109.5°
H4C4H5109.5°109.4°
H6C3H7109.4°109.5°
H8C2H9109.5°109.5°
H10C5H11109.5°109.5°
H12C6H13109.5°109.5°
H14C7H15109.5°109.5°
H18C10H19109.5°109.4°
H20C9H21109.5°109.5°
H22C8H23109.5°109.5°
H24C13H25109.5°109.5°
H26C14H27109.4°109.5°
H28C15H29109.5°109.5°
H31C16H32109.5°109.5°
H33C17H34109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C7C6C5H12120.7°120.0°
C7C6C5H13120.8°120.0°
C6C7C8H14120.4°119.9°
C6C7C8H15120.4°120.0°
C7C6C5C4176.4°179.9°
C6C7C8C9160.5°180.0°
C7C6C5H1056.2°60.0°
C7C6C5H1163.4°60.0°
C7C6H12H13117.6°120.0°
C6C7H14H15118.9°120.0°
C6C7C8H2279.0°60.1°
C6C7C8H2339.9°60.0°
C5C6C7C861.4°180.0°
C6C5C4H10120.2°120.0°
C6C5C4H11120.2°120.0°
C6C5C4C3167.3°180.0°
C6C5C4H472.0°59.9°
C6C5C4H546.5°60.0°
C6C5H10H11119.4°120.0°
C5C6H12H13117.6°120.0°
C5C6C7H14178.3°60.0°
C5C6C7H1559.0°60.0°
C7C8C9H22120.6°120.0°
C7C8C9H23120.5°120.0°
C7C8C9C10178.0°180.0°
C8C7C6H12177.9°60.0°
C8C7C6H1359.4°60.0°
C8C7H14H15118.9°120.1°
C7C8C9H2058.1°60.0°
C7C8C9H2162.0°60.0°
C7C8H22H23118.2°120.0°
C5C4C3H4120.7°120.1°
C5C4C3H5120.7°120.0°
C5C4C3C282.0°180.0°
C5C4H4H5117.8°119.9°
C5C4C3H638.5°60.0°
C5C4C3H7157.4°60.0°
C4C5H10H11119.3°119.9°
C4C5C6H1262.9°60.0°
C4C5C6H1355.6°60.0°
C4C3C2H6120.6°120.0°
C4C3C2H7120.6°120.0°
C4C3C2C1175.6°180.0°
C3C4H4H5117.9°120.0°
C4C3H6H7118.2°120.0°
C4C3C2H855.0°60.0°
C4C3C2H963.7°60.0°
C3C4C5H1047.0°60.0°
C3C4C5H1172.5°60.0°
C8C9C10H20119.9°120.0°
C8C9C10H21119.9°120.0°
C8C9C10C1177.7°180.0°
C9C8C7H1440.1°60.0°
C9C8C7H1579.2°60.0°
C8C9C10H1842.3°60.0°
C8C9C10H19162.3°60.0°
C8C9H20H21120.2°119.9°
C9C8H22H23118.3°120.0°
C3C2C1H8120.7°120.0°
C3C2C1H9120.7°120.0°
C3C2C1O120.8°0.0°
C3C2C1O2159.9°180.0°
C2C3C4H4157.3°60.0°
C2C3C4H538.7°60.0°
C2C3H6H7118.2°120.0°
C3C2H8H9117.9°120.0°
C9C10C11H18120.0°120.0°
C9C10C11H19120.0°120.0°
C9C10C11C12123.6°126.3°
C9C10C11H1756.4°53.7°
C9C10H18H19120.0°120.0°
C10C9H20H21120.2°120.1°
C10C9C8H2261.4°60.0°
C10C9C8H2357.5°60.0°
C2C1O1O2179.3°180.0°
C1C2C3H663.8°60.0°
C1C2C3H755.0°60.0°
C1C2H8H9117.8°120.1°
C2C1O2H30179.3°180.0°
C10C11C12H17180.0°180.0°
C10C11C12C130.2°7.5°
C10C11C12H16179.8°172.4°
C11C10H18H19120.1°120.0°
C11C10C9H20162.4°60.1°
C11C10C9H2142.3°60.0°
O1C1C2H8141.5°120.0°
O1C1C2H999.9°120.0°
O1C1O2H300.0°0.0°
O2C1C2H839.2°60.0°
O2C1C2H979.4°60.0°
C11C12C13H16180.0°179.9°
C11C12C13C14151.5°127.7°
C12C11C10H183.6°113.6°
C12C11C10H19116.5°6.3°
C11C12C13H2431.4°112.4°
C11C12C13H2588.4°7.6°
C15C16C17H31120.3°120.0°
C15C16C17H32120.3°120.0°
C16C15C14H28120.4°120.0°
C16C15C14H29120.3°120.0°
C16C15C14C1383.6°180.0°
C15C16C17C18172.0°180.0°
C16C15C14H2636.8°60.0°
C16C15C14H27156.1°59.9°
C16C15H28H29118.9°120.0°
C15C16H31H32119.1°120.0°
C15C16C17H3351.9°60.0°
C15C16C17H3468.0°60.0°
C17C16C15C1464.7°180.0°
C16C17C18H33120.0°120.0°
C16C17C18H34120.0°120.0°
C16C17C18H1180.0°180.0°
C16C17C18H260.0°60.0°
C16C17C18H360.0°60.0°
C17C16C15H2855.7°60.0°
C17C16C15H29175.0°60.0°
C17C16H31H32119.1°120.0°
C16C17H33H34119.9°120.0°
C12C13C14C1577.5°180.0°
C12C13C14H24120.1°120.0°
C12C13C14H25120.1°120.0°
C13C12C11H17179.8°172.5°
C12C13H24H25119.7°120.0°
C12C13C14H2642.9°60.0°
C12C13C14H27162.2°60.0°
C15C14C13H26120.3°119.9°
C15C14C13H27120.3°120.0°
C15C14C13H2442.6°60.1°
C15C14C13H25162.4°60.0°
C15C14H26H27119.1°119.9°
C14C15H28H29119.0°120.0°
C14C15C16H3155.6°60.0°
C14C15C16H32175.1°59.9°
C14C13C12H1628.6°52.4°
C14C13H24H25119.7°120.0°
C13C14H26H27119.0°120.1°
C13C14C15H28156.1°60.0°
C13C14C15H2936.8°59.9°
C17C18H1H2120.0°120.0°
C17C18H1H3120.0°119.9°
C17C18H2H3120.0°119.9°
C18C17C16H3167.7°60.0°
C18C17C16H3251.7°60.0°
C18C17H33H34119.9°120.0°
H1C18H2H3120.0°120.1°
H1C18C17H3360.0°60.1°
H1C18C17H3460.0°60.0°
H2C18C17H33180.0°60.0°
H2C18C17H3460.0°180.0°
H3C18C17H3360.0°180.0°
H3C18C17H34180.0°60.0°
H4C4C3H682.1°60.0°
H4C4C3H736.7°180.0°
H4C4C5H10167.7°180.0°
H4C4C5H1148.2°60.0°
H5C4C3H6159.3°180.0°
H5C4C3H781.9°60.0°
H5C4C5H1073.7°60.0°
H5C4C5H11166.8°180.0°
H6C3C2H8175.6°180.0°
H6C3C2H956.9°60.0°
H7C3C2H865.6°60.0°
H7C3C2H9175.7°180.0°
H10C5C6H12176.9°180.0°
H10C5C6H1364.6°60.0°
H11C5C6H1257.3°60.0°
H11C5C6H13175.8°179.9°
H12C6C7H1457.5°180.0°
H12C6C7H1561.8°60.0°
H13C6C7H1461.0°60.0°
H13C6C7H15179.8°180.0°
H14C7C8H22160.7°180.0°
H14C7C8H2380.5°60.0°
H15C7C8H2241.4°60.0°
H15C7C8H23160.3°180.0°
H16C12C11H170.2°7.6°
H16C12C13H24148.6°67.5°
H16C12C13H2591.5°172.4°
H17C11C10H18176.4°66.4°
H17C11C10H1963.6°173.7°
H18C10C9H2077.6°179.9°
H18C10C9H21162.2°60.0°
H19C10C9H2042.4°60.0°
H19C10C9H2177.8°180.0°
H20C9C8H22178.7°60.0°
H20C9C8H2362.4°180.0°
H21C9C8H2258.6°180.0°
H21C9C8H23177.4°60.0°
H24C13C14H26162.9°180.0°
H24C13C14H2777.7°60.0°
H25C13C14H2677.2°60.0°
H25C13C14H2742.1°180.0°
H26C14C15H2883.6°180.0°
H26C14C15H29157.1°60.0°
H27C14C15H2835.8°60.1°
H27C14C15H2983.6°180.0°
H28C15C16H31176.0°180.0°
H28C15C16H3264.6°60.0°
H29C15C16H3164.7°60.0°
H29C15C16H3254.7°NaN°
H31C16C17H33172.3°60.0°
H31C16C17H3452.3°180.0°
H32C16C17H3368.3°180.0°
H32C16C17H34171.7°60.0°

222415

PDB entries from 2024-07-10

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