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H3F

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C01C02sing1.51Å1.49Å
F31C28sing1.40Å1.34Å
C03C02doub1.36Å1.44ÅAromatic
C03C04sing1.40Å1.45ÅAromatic
F30C28sing1.40Å1.31Å
O32C33sing1.43Å1.42Å
O32C04sing1.36Å1.54Å
C02C07sing1.41Å1.51ÅAromatic
C25C24doub1.38Å1.38ÅAromatic
C25C26sing1.38Å1.41ÅAromatic
C28C26sing1.51Å1.54Å
C28F29sing1.40Å1.36Å
C24C23sing1.38Å1.40ÅAromatic
C04N05doub1.31Å1.38ÅAromatic
C26C27doub1.38Å1.39ÅAromatic
C23C22doub1.39Å1.42ÅAromatic
C27C22sing1.39Å1.37ÅAromatic
C22O21sing1.36Å1.38Å
C07C08doub1.41Å1.59ÅAromatic
C07C06sing1.42Å1.48ÅAromatic
O21C08sing1.36Å1.48Å
N05C06sing1.34Å1.49ÅAromatic
C08C09sing1.38Å1.41ÅAromatic
C06C11doub1.41Å1.49ÅAromatic
C09O19sing1.36Å1.47Å
C09C10doub1.39Å1.47ÅAromatic
C11C10sing1.38Å1.41ÅAromatic
C11N12sing1.40Å1.41Å
O19C20sing1.43Å1.46Å
N12C13sing1.46Å1.50Å
N18C17sing1.47Å1.49Å
C13C15sing1.53Å1.68Å
C13C14sing1.53Å1.51Å
C15C16sing1.53Å1.60Å
C17C16sing1.53Å1.57Å
C01H1sing1.09Å1.10Å
C01H2sing1.09Å1.10Å
C01H3sing1.09Å1.10Å
C03H4sing1.08Å1.08Å
C10H5sing1.08Å1.08Å
N12H6sing0.97Å1.00Å
C13H7sing1.09Å1.10Å
C14H8sing1.09Å1.10Å
C14H9sing1.09Å1.10Å
C14H10sing1.09Å1.10Å
C15H11sing1.09Å1.10Å
C15H12sing1.09Å1.10Å
C16H13sing1.09Å1.10Å
C16H14sing1.09Å1.10Å
C17H15sing1.09Å1.10Å
C17H16sing1.09Å1.10Å
N18H17sing1.01Å1.00Å
N18H18sing1.01Å1.00Å
C20H20sing1.09Å1.10Å
C20H21sing1.09Å1.10Å
C20H22sing1.09Å1.10Å
C23H23sing1.08Å1.08Å
C24H24sing1.08Å1.08Å
C25H25sing1.08Å1.08Å
C27H26sing1.08Å1.08Å
C33H27sing1.09Å1.10Å
C33H28sing1.09Å1.10Å
C33H29sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C01C02C03115.7°120.8°
C01C02C07121.7°120.9°
C02C01H1109.5°109.5°
C02C01H2109.5°109.5°
C02C01H3109.5°109.4°
F31C28F30106.8°109.5°
F31C28C26112.2°109.5°
F31C28F29104.6°109.5°
C02C03C04122.0°119.9°
C03C02C07122.5°118.3°
C02C03H4119.0°120.1°
C03C04O32120.5°119.2°
C03C04N05119.0°121.6°
C04C03H4119.0°120.1°
F30C28C26111.6°109.5°
F30C28F29109.4°109.4°
C33O32C04122.7°117.0°
O32C33H27109.5°109.5°
O32C33H28109.4°109.4°
O32C33H29109.5°109.5°
O32C04N05120.5°119.3°
C02C07C08129.3°121.2°
C02C07C06111.8°119.1°
C24C25C26117.2°120.1°
C25C24C23119.4°120.0°
C25C24H24120.3°119.9°
C24C25H25121.4°119.9°
C25C26C28118.5°119.9°
C25C26C27124.4°120.1°
C26C25H25121.4°120.0°
C26C28F29111.9°109.5°
C28C26C27117.1°120.0°
C24C23C22122.1°120.0°
C24C23H23119.0°120.0°
C23C24H24120.3°120.0°
C04N05C06120.5°121.3°
C26C27C22118.3°119.9°
C26C27H26120.9°120.0°
C23C22C27118.7°119.9°
C23C22O21119.3°120.1°
C22C23H23119.0°120.0°
C27C22O21122.0°120.0°
C22C27H26120.8°120.0°
C22O21C08136.7°118.0°
C08C07C06118.8°119.7°
C07C08O21129.7°120.2°
C07C08C09117.7°119.7°
C07C06N05124.0°119.8°
C07C06C11120.1°119.3°
O21C08C09112.3°120.1°
N05C06C11115.9°120.8°
C08C09O19119.2°119.7°
C08C09C10120.2°120.6°
C06C11C10117.8°119.8°
C06C11N12120.4°120.1°
O19C09C10120.6°119.7°
C09O19C20122.3°117.0°
C09C10C11125.4°120.8°
C09C10H5117.3°119.6°
C10C11N12121.8°120.1°
C11C10H5117.3°119.6°
C11N12C13127.7°120.0°
C11N12H6104.7°120.0°
O19C20H20109.5°109.5°
O19C20H21109.4°109.4°
O19C20H22109.4°109.4°
N12C13C15115.0°109.5°
N12C13C14109.1°109.5°
C13N12H6104.7°120.0°
N12C13H7108.4°109.5°
N18C17C16112.7°109.4°
N18C17H15108.7°109.4°
N18C17H16108.7°109.5°
C17N18H17109.5°111.1°
C17N18H18109.4°110.9°
C15C13C14109.2°109.5°
C13C15C16121.6°109.5°
C15C13H7106.5°109.4°
C13C15H11106.3°109.5°
C13C15H12106.3°109.5°
C14C13H7108.4°109.5°
C13C14H8109.5°109.5°
C13C14H9109.4°109.5°
C13C14H10109.4°109.5°
C15C16C17116.9°109.5°
C16C15H11106.4°109.4°
C16C15H12106.4°109.5°
C15C16H13107.6°109.4°
C15C16H14107.6°109.5°
C17C16H13107.6°109.4°
C17C16H14107.6°109.5°
C16C17H15108.7°109.4°
C16C17H16108.7°109.5°
H1C01H2109.4°109.5°
H1C01H3109.5°109.5°
H2C01H3109.5°109.5°
H8C14H9109.5°109.4°
H8C14H10109.5°109.5°
H9C14H10109.5°109.5°
H11C15H12109.5°109.4°
H13C16H14109.4°109.5°
H15C17H16109.5°109.5°
H17N18H18109.5°111.1°
H20C20H21109.5°109.5°
H20C20H22109.5°109.5°
H21C20H22109.5°109.5°
H27C33H28109.5°109.5°
H27C33H29109.5°109.5°
H28C33H29109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C01C02C03C07179.2°179.8°
C01C02C03C04179.4°180.0°
C01C02C07C081.3°0.0°
C01C02C07C06179.2°179.7°
C02C01H1H2120.0°120.0°
C02C01H1H3120.0°120.0°
C02C01H2H3120.0°120.0°
C01C02C03H40.6°0.0°
F31C28F30C26122.9°120.0°
F31C28F30F29112.7°120.0°
F31C28C26C2524.8°120.0°
F31C28C26F29117.2°120.0°
F31C28C26C27154.8°60.2°
C02C03C04H4180.0°179.9°
C02C03C04O32179.0°180.0°
C02C03C04N050.2°0.0°
C03C02C07C08177.8°179.7°
C03C02C07C060.1°0.5°
C03C02C01H189.7°97.6°
C03C02C01H2150.3°22.5°
C03C02C01H330.4°142.4°
C03C04O32C3373.2°180.0°
C03C04O32N05178.8°180.0°
C04C03C02C070.2°0.3°
C03C04N05C060.8°0.0°
F30C28C26C25144.6°120.0°
F30C28C26F29123.0°120.0°
F30C28C26C2735.0°59.8°
C33O32C04N05108.0°0.0°
O32C33H27H28120.0°120.0°
O32C33H27H29120.0°120.0°
O32C33H28H29120.0°120.0°
O32C04N05C06179.6°180.0°
O32C04C03H41.0°0.1°
C04O32C33H27180.0°60.0°
C04O32C33H2860.0°180.0°
C04O32C33H2960.0°60.0°
C02C07C08C06177.8°179.7°
C02C07C08O217.1°0.0°
C02C07C06N050.5°0.5°
C02C07C08C09179.7°180.0°
C02C07C06C11179.9°179.7°
C07C02C01H189.5°82.2°
C07C02C01H230.5°157.8°
C07C02C01H3150.5°37.8°
C07C02C03H4179.8°179.8°
C24C25C26H25180.0°180.0°
C24C25C26C28179.9°179.9°
C25C24C23H24180.0°179.9°
C24C25C26C270.3°0.3°
C25C24C23C221.1°0.1°
C25C24C23H23178.9°180.0°
C25C26C28C27179.6°179.8°
C25C26C28F2992.4°0.1°
C26C25C24C230.6°0.0°
C25C26C27C220.4°0.6°
C26C25C24H24179.4°180.0°
C25C26C27H26179.6°180.0°
C28C26C27C22180.0°179.6°
C28C26C25H250.1°0.1°
C28C26C27H260.0°0.2°
F29C28C26C2788.0°179.7°
C24C23C22H23180.0°179.9°
C24C23C22C271.1°0.4°
C24C23C22O21179.3°180.0°
C23C24C25H25179.4°179.9°
C04N05C06C071.0°0.2°
C04N05C06C11179.4°180.0°
N05C04C03H4179.8°179.9°
C26C27C22C230.8°0.6°
C26C27C22H26180.0°179.4°
C26C27C22O21178.9°179.8°
C27C26C25H25179.7°179.7°
C23C22C27O21178.1°179.6°
C23C22O21C08165.3°0.1°
C22C23C24H24178.9°180.0°
C23C22C27H26179.3°180.0°
C27C22O21C0816.5°179.7°
C27C22C23H23178.8°179.8°
C22O21C08C0763.1°99.0°
C22O21C08C09124.0°80.9°
O21C22C23H230.6°0.1°
O21C22C27H261.1°0.4°
C07C08O21C09172.9°180.0°
C08C07C06N05178.7°179.7°
C08C07C06C111.8°0.0°
C07C08C09O19177.8°180.0°
C07C08C09C102.1°0.0°
C06C07C08O21175.1°179.7°
C07C06N05C11179.5°179.8°
C06C07C08C092.6°0.3°
C07C06C11C100.6°0.6°
C07C06C11N12179.2°179.7°
O21C08C09O194.0°0.0°
O21C08C09C10175.9°180.0°
N05C06C11C10179.8°179.1°
N05C06C11N121.3°0.0°
C08C09O19C10179.9°180.0°
C08C09C10C111.0°0.6°
C08C09O19C2062.7°180.0°
C08C09C10H5179.0°179.9°
C06C11C10C090.1°0.9°
C06C11C10N12178.6°179.1°
C06C11N12C1371.2°180.0°
C06C11C10H5179.9°179.6°
C06C11N12H651.2°0.0°
O19C09C10C11179.0°179.4°
O19C09C10H51.1°0.1°
C09O19C20H20180.0°59.9°
C09O19C20H2160.0°180.0°
C09O19C20H2260.0°60.0°
C09C10C11H5180.0°179.4°
C09C10C11N12178.7°180.0°
C10C09O19C20117.4°0.0°
C10C11N12C13107.4°0.9°
C10C11N12H6130.3°179.1°
C11N12C13H6122.4°180.0°
C11N12C13C152.2°155.0°
C11N12C13C14120.9°85.0°
N12C11C10H51.3°0.5°
C11N12C13H7121.2°35.0°
O19C20H20H21120.0°120.0°
O19C20H20H22120.0°119.9°
O19C20H21H22120.0°119.9°
N12C13C15C14123.0°120.0°
N12C13C15H7120.1°120.0°
N12C13C14H7117.9°120.0°
N12C13C15C16177.4°65.0°
N12C13C14H8180.0°180.0°
N12C13C14H960.0°60.0°
N12C13C14H1060.0°60.0°
N12C13C15H1160.9°175.0°
N12C13C15H1255.7°55.0°
N18C17C16C1592.2°180.0°
N18C17C16H15120.5°119.9°
N18C17C16H16120.5°120.1°
N18C17C16H13146.7°60.1°
N18C17C16H1428.9°59.9°
N18C17H15H16118.5°120.1°
C17N18H17H18120.0°124.0°
C15C13C14H7115.6°120.0°
C13C15C16H11121.7°120.0°
C13C15C16H12121.7°120.0°
C13C15C16C1734.9°180.0°
C15C13N12H6120.2°25.0°
C15C13C14H853.6°60.0°
C15C13C14H9173.6°180.0°
C15C13C14H1066.4°60.0°
C13C15H11H12114.5°120.0°
C13C15C16H1386.2°60.0°
C13C15C16H14156.0°60.0°
C14C13C15C1659.6°175.0°
C14C13N12H6116.7°95.0°
C13C14H8H9120.0°120.0°
C13C14H8H10120.0°120.0°
C13C14H9H10120.0°120.0°
C14C13C15H1162.1°55.0°
C14C13C15H12178.7°65.0°
C15C16C17H13121.1°119.9°
C15C16C17H14121.1°120.1°
C16C15C13H757.3°55.0°
C16C15H11H12114.6°120.0°
C15C16H13H14116.6°120.0°
C15C16C17H15147.3°60.1°
C15C16C17H1628.3°60.0°
C17C16C15H11156.5°60.0°
C17C16C15H1286.8°59.9°
C17C16H13H14116.6°120.1°
C16C17H15H16118.5°120.0°
C16C17N18H17180.0°56.0°
C16C17N18H1860.0°180.0°
H1C01H2H3120.0°120.0°
H6N12C13H71.1°145.0°
H7C13C14H862.1°60.0°
H7C13C14H957.9°60.0°
H7C13C14H10177.9°NaN°
H7C13C15H11179.0°65.0°
H7C13C15H1264.4°175.0°
H8C14H9H10120.0°120.0°
H11C15C16H1335.4°180.0°
H11C15C16H1482.4°60.0°
H12C15C16H13152.1°60.0°
H12C15C16H1434.3°180.0°
H13C16C17H1526.2°180.0°
H13C16C17H1692.8°60.0°
H14C16C17H1591.6°60.0°
H14C16C17H16149.3°180.0°
H15C17N18H1759.5°63.9°
H15C17N18H1860.5°60.1°
H16C17N18H1759.5°176.0°
H16C17N18H18179.6°60.0°
H20C20H21H22120.0°120.0°
H23C23C24H241.1°0.1°
H24C24C25H250.6°0.0°
H27C33H28H29120.0°120.0°

224201

PDB entries from 2024-08-28

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