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2HD

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C17C18sing1.53Å1.51Å
C17C16sing1.53Å1.53Å
C15O14sing1.43Å1.43Å
C15C16sing1.53Å1.53Å
O14C13sing1.43Å1.42Å
C11O10sing1.43Å1.41Å
C11C12sing1.53Å1.53Å
O20P9doub1.48Å1.55Å
P9O10sing1.61Å1.56Å
P9C8sing1.82Å1.80Å
C12C13sing1.53Å1.53Å
C12O21sing1.43Å1.44Å
C8C7sing1.53Å1.50Å
O21C22sing1.43Å1.44Å
C7C6sing1.53Å1.55Å
C22C23sing1.53Å1.53Å
C6C5sing1.53Å1.51Å
C23C24sing1.53Å1.53Å
C5C4sing1.53Å1.51Å
C24C25sing1.53Å1.51Å
C4C3sing1.53Å1.51Å
C3C2sing1.53Å1.53Å
C2C1sing1.53Å1.52Å
C8H2sing1.09Å1.10Å
C8H3sing1.09Å1.10Å
C7H4sing1.09Å1.10Å
C7H5sing1.09Å1.10Å
C6H6sing1.09Å1.10Å
C6H7sing1.09Å1.10Å
C5H8sing1.09Å1.10Å
C5H9sing1.09Å1.10Å
C4H10sing1.09Å1.10Å
C4H11sing1.09Å1.10Å
C3H12sing1.09Å1.10Å
C3H13sing1.09Å1.10Å
C2H14sing1.09Å1.10Å
C2H15sing1.09Å1.10Å
C1H16sing1.09Å1.10Å
C1H17sing1.09Å1.10Å
C1H18sing1.09Å1.10Å
C11H19sing1.09Å1.10Å
C11H20sing1.09Å1.10Å
C12H21sing1.09Å1.10Å
C22H22sing1.09Å1.10Å
C22H23sing1.09Å1.10Å
C23H24sing1.09Å1.10Å
C23H25sing1.09Å1.10Å
C24H26sing1.09Å1.10Å
C24H27sing1.09Å1.10Å
C25H28sing1.09Å1.10Å
C25H29sing1.09Å1.10Å
C25H30sing1.09Å1.10Å
C13H31sing1.09Å1.10Å
C13H32sing1.09Å1.10Å
C15H33sing1.09Å1.10Å
C15H34sing1.09Å1.10Å
C16H35sing1.09Å1.10Å
C16H36sing1.09Å1.10Å
C17H37sing1.09Å1.10Å
C17H38sing1.09Å1.10Å
C18H39sing1.09Å1.10Å
C18H40sing1.09Å1.10Å
C18H41sing1.09Å1.10Å
P9H1sing1.42Å1.42Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C18C17C16108.7°109.5°
C18C17H37109.6°109.4°
C18C17H38109.6°109.5°
C17C18H39109.5°109.5°
C17C18H40109.5°109.4°
C17C18H41109.4°109.5°
C17C16C15112.5°109.5°
C17C16H35108.7°109.4°
C17C16H36108.7°109.5°
C16C17H37109.7°109.4°
C16C17H38109.7°109.5°
O14C15C16111.4°109.5°
C15O14C13113.2°114.0°
O14C15H33109.0°109.5°
O14C15H34109.0°109.5°
C16C15H33109.0°109.4°
C16C15H34109.0°109.5°
C15C16H35108.7°109.4°
C15C16H36108.7°109.5°
O14C13C12106.1°109.5°
O14C13H31110.3°109.4°
O14C13H32110.3°109.5°
O10C11C12114.9°109.5°
C11O10P9112.3°123.0°
O10C11H19108.1°109.4°
O10C11H20108.1°109.4°
C11C12C13107.5°109.5°
C11C12O21110.3°109.5°
C12C11H19108.1°109.5°
C12C11H20108.1°109.5°
C11C12H21106.8°109.5°
O20P9O10104.3°109.5°
O20P9C8114.5°109.4°
O20P9H1107.9°109.5°
O10P9C8116.7°109.5°
O10P9H1107.8°109.5°
P9C8C7111.2°109.5°
P9C8H2109.0°109.5°
P9C8H3109.1°109.5°
C8P9H1105.3°109.5°
C13C12O21117.3°109.4°
C13C12H21106.7°109.5°
C12C13H31110.3°109.4°
C12C13H32110.3°109.5°
C12O21C22119.4°114.0°
O21C12H21107.8°109.4°
C8C7C6108.5°109.5°
C7C8H2109.0°109.5°
C7C8H3109.0°109.5°
C8C7H4109.7°109.5°
C8C7H5109.7°109.5°
O21C22C23111.3°109.5°
O21C22H22109.0°109.4°
O21C22H23109.0°109.5°
C7C6C5105.5°109.5°
C6C7H4109.7°109.5°
C6C7H5109.7°109.5°
C7C6H6110.5°109.5°
C7C6H7110.5°109.5°
C22C23C24109.7°109.5°
C23C22H22109.0°109.4°
C23C22H23109.0°109.5°
C22C23H24109.4°109.5°
C22C23H25109.4°109.5°
C6C5C4111.1°109.5°
C5C6H6110.4°109.5°
C5C6H7110.5°109.5°
C6C5H8109.1°109.5°
C6C5H9109.1°109.5°
C23C24C25113.7°109.5°
C24C23H24109.4°109.4°
C24C23H25109.4°109.5°
C23C24H26108.4°109.5°
C23C24H27108.4°109.5°
C5C4C3104.2°109.5°
C4C5H8109.1°109.4°
C4C5H9109.1°109.5°
C5C4H10110.8°109.5°
C5C4H11110.8°109.5°
C25C24H26108.4°109.5°
C25C24H27108.4°109.5°
C24C25H28109.5°109.5°
C24C25H29109.5°109.4°
C24C25H30109.5°109.5°
C4C3C2113.7°109.5°
C3C4H10110.8°109.5°
C3C4H11110.8°109.5°
C4C3H12108.4°109.5°
C4C3H13108.4°109.5°
C3C2C1109.6°109.5°
C2C3H12108.4°109.5°
C2C3H13108.4°109.5°
C3C2H14109.5°109.5°
C3C2H15109.4°109.5°
C1C2H14109.4°109.5°
C1C2H15109.5°109.5°
C2C1H16109.5°109.5°
C2C1H17109.4°109.5°
C2C1H18109.5°109.4°
H2C8H3109.5°109.4°
H4C7H5109.5°109.5°
H6C6H7109.4°109.5°
H8C5H9109.5°109.5°
H10C4H11109.5°109.4°
H12C3H13109.5°109.5°
H14C2H15109.5°109.5°
H16C1H17109.4°109.5°
H16C1H18109.5°109.5°
H17C1H18109.5°109.5°
H19C11H20109.5°109.5°
H22C22H23109.5°109.5°
H24C23H25109.5°109.4°
H26C24H27109.5°109.4°
H28C25H29109.4°109.5°
H28C25H30109.5°109.5°
H29C25H30109.5°109.5°
H31C13H32109.5°109.5°
H33C15H34109.5°109.5°
H35C16H36109.5°109.5°
H37C17H38109.5°109.5°
H39C18H40109.5°109.5°
H39C18H41109.5°109.5°
H40C18H41109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C18C17C16H37119.9°120.0°
C18C17C16H38119.9°120.0°
C18C17C16C15176.3°180.0°
C18C17C16H3555.9°60.0°
C18C17C16H3663.3°59.9°
C18C17H37H38120.3°120.0°
C17C18H39H40120.0°120.0°
C17C18H39H41120.0°120.0°
C17C18H40H41120.0°120.0°
C17C16C15O1442.6°180.0°
C17C16C15H35120.5°120.0°
C17C16C15H36120.4°120.0°
C17C16C15H33162.9°60.0°
C17C16C15H3477.7°60.0°
C17C16H35H36118.6°120.0°
C16C17H37H38120.4°120.0°
C16C17C18H39180.0°180.0°
C16C17C18H4060.0°60.0°
C16C17C18H4160.0°59.9°
O14C15C16H33120.3°120.0°
O14C15C16H34120.3°120.0°
C15O14C13C12174.0°180.0°
C15O14C13H3154.6°60.0°
C15O14C13H3266.5°60.0°
O14C15H33H34119.1°120.0°
O14C15C16H35163.1°60.0°
O14C15C16H3677.8°60.0°
C16C15O14C1375.2°180.0°
C16C15H33H34119.1°120.0°
C15C16H35H36118.6°120.0°
C15C16C17H3763.8°60.0°
C15C16C17H3856.4°60.0°
O14C13C12C1165.2°175.0°
O14C13C12H31119.5°119.9°
O14C13C12H32119.5°120.1°
O14C13C12O21170.0°65.0°
O14C13C12H2149.1°55.0°
O14C13H31H32121.5°120.0°
C13O14C15H3345.1°60.1°
C13O14C15H34164.5°60.0°
O10C11C12H19120.8°119.9°
O10C11C12H20120.8°120.0°
C11O10P9O20149.7°60.0°
C11O10P9C882.9°180.0°
O10C11C12C1363.2°175.0°
O10C11C12O2165.7°65.0°
O10C11H19H20117.5°119.9°
O10C11C12H21177.4°54.9°
C11O10P9H135.2°60.0°
C12C11O10P9148.6°180.0°
C11C12C13O21124.8°120.0°
C11C12C13H21114.2°120.0°
C11C12O21H21116.2°120.0°
C11C12O21C22101.4°150.0°
C12C11H19H20117.5°120.1°
C11C12C13H31175.4°55.1°
C11C12C13H3254.3°64.9°
O20P9O10C8127.4°120.0°
O20P9O10H1114.5°120.0°
O20P9C8H1118.3°119.9°
O20P9C8C781.4°60.0°
O20P9C8H238.8°180.0°
O20P9C8H3158.3°60.0°
O10P9C8H1119.4°120.0°
O10P9C8C740.8°180.0°
O10P9C8H2161.0°60.0°
O10P9C8H379.5°60.0°
P9O10C11H1927.8°60.0°
P9O10C11H2090.7°60.0°
P9C8C7H2120.3°120.0°
P9C8C7H3120.3°120.0°
P9C8C7C6159.5°180.0°
P9C8H2H3119.2°120.0°
P9C8C7H480.7°60.0°
P9C8C7H539.7°60.0°
C13C12O21H21120.4°120.0°
C13C12O21C2222.0°90.0°
C13C12C11H19176.0°55.1°
C13C12C11H2057.6°65.0°
C12C13H31H32121.6°120.0°
C12O21C22C23127.3°180.0°
O21C12C11H1955.1°175.0°
O21C12C11H20173.5°54.9°
C12O21C22H227.0°60.0°
C12O21C22H23112.5°60.0°
O21C12C13H3150.6°175.0°
O21C12C13H3270.5°55.0°
C8C7C6H4119.8°120.0°
C8C7C6H5119.8°120.0°
C8C7C6C5164.9°180.0°
C7C8H2H3119.2°120.0°
C8C7H4H5120.5°120.0°
C8C7C6H675.7°60.0°
C8C7C6H745.5°60.0°
C7C8P9H1160.2°60.0°
O21C22C23H22120.3°120.0°
O21C22C23H23120.3°120.0°
O21C22C23C24174.9°180.0°
C22O21C12H21142.4°30.0°
O21C22H22H23119.1°120.0°
O21C22C23H2454.8°60.0°
O21C22C23H2565.1°59.9°
C7C6C5H6119.4°120.0°
C7C6C5H7119.4°120.0°
C7C6C5C4159.3°180.0°
C6C7C8H239.3°59.9°
C6C7C8H380.2°60.0°
C6C7H4H5120.5°120.0°
C7C6H6H7121.8°120.0°
C7C6C5H839.0°60.0°
C7C6C5H980.5°60.0°
C22C23C24H24120.0°120.0°
C22C23C24H25120.0°120.1°
C22C23C24C2598.0°180.0°
C23C22H22H23119.2°120.0°
C22C23H24H25119.9°120.0°
C22C23C24H26141.4°60.0°
C22C23C24H2722.6°59.9°
C6C5C4H8120.2°120.0°
C6C5C4H9120.3°120.0°
C6C5C4C3174.7°180.0°
C5C6C7H445.1°60.0°
C5C6C7H575.3°60.0°
C5C6H6H7121.8°120.0°
C6C5H8H9119.3°120.0°
C6C5C4H1055.6°60.0°
C6C5C4H1166.1°60.0°
C23C24C25H26120.6°120.0°
C23C24C25H27120.6°120.1°
C24C23C22H2264.8°60.1°
C24C23C22H2354.6°60.0°
C24C23H24H25119.9°120.0°
C23C24H26H27118.1°120.0°
C23C24C25H28180.0°180.0°
C23C24C25H2960.0°60.0°
C23C24C25H3060.0°60.0°
C5C4C3H10119.2°120.0°
C5C4C3H11119.2°120.0°
C5C4C3C2155.1°180.0°
C4C5C6H681.3°60.0°
C4C5C6H739.9°60.0°
C4C5H8H9119.3°120.0°
C5C4H10H11122.5°120.0°
C5C4C3H1234.5°60.0°
C5C4C3H1384.3°60.0°
C25C24C23H2422.0°60.0°
C25C24C23H25142.0°59.9°
C25C24H26H27118.1°120.0°
C24C25H28H29120.0°119.9°
C24C25H28H30120.0°120.0°
C24C25H29H30120.0°120.0°
C4C3C2H12120.6°120.0°
C4C3C2H13120.6°120.0°
C4C3C2C1177.7°180.0°
C3C4C5H865.1°60.0°
C3C4C5H954.4°60.0°
C3C4H10H11122.4°120.0°
C4C3H12H13118.1°120.0°
C4C3C2H1462.3°60.0°
C4C3C2H1557.7°60.0°
C3C2C1H14120.0°120.0°
C3C2C1H15120.0°120.0°
C2C3C4H1085.7°59.9°
C2C3C4H1136.0°60.0°
C2C3H12H13118.0°120.0°
C3C2H14H15119.9°120.0°
C3C2C1H16180.0°60.0°
C3C2C1H1760.0°60.0°
C3C2C1H1860.0°180.0°
C1C2C3H1257.1°60.0°
C1C2C3H1361.7°60.0°
C1C2H14H15120.0°120.0°
C2C1H16H17120.0°120.0°
C2C1H16H18120.0°119.9°
C2C1H17H18120.0°120.0°
H2C8C7H4159.1°180.0°
H2C8C7H580.6°60.0°
H2C8P9H179.5°60.1°
H3C8C7H439.6°60.1°
H3C8C7H5160.0°180.0°
H3C8P9H139.9°180.0°
H4C7C6H6164.5°180.0°
H4C7C6H774.3°60.0°
H5C7C6H644.1°60.0°
H5C7C6H7165.4°180.0°
H6C6C5H8158.4°180.0°
H6C6C5H938.9°60.0°
H7C6C5H880.3°60.0°
H7C6C5H9160.1°180.0°
H8C5C4H10175.8°180.0°
H8C5C4H1154.1°60.0°
H9C5C4H1064.7°60.0°
H9C5C4H11173.6°180.0°
H10C4C3H12153.7°179.9°
H10C4C3H1334.9°60.0°
H11C4C3H1284.7°60.0°
H11C4C3H13156.6°180.0°
H12C3C2H14177.1°180.0°
H12C3C2H1563.0°60.0°
H13C3C2H1458.3°60.0°
H13C3C2H15178.3°180.0°
H14C2C1H1660.0°180.0°
H14C2C1H17180.0°60.0°
H14C2C1H1860.0°60.0°
H15C2C1H1660.0°60.0°
H15C2C1H1760.0°180.0°
H15C2C1H18180.0°60.0°
H16C1H17H18120.0°120.0°
H19C11C12H2161.8°65.0°
H20C11C12H2156.6°174.9°
H21C12C13H3170.4°65.0°
H21C12C13H32168.5°175.0°
H22C22C23H24175.1°180.0°
H22C22C23H2555.2°60.0°
H23C22C23H2465.4°60.0°
H23C22C23H25174.6°180.0°
H24C23C24H2698.6°180.0°
H24C23C24H27142.6°60.1°
H25C23C24H2621.4°60.1°
H25C23C24H2797.4°180.0°
H26C24C25H2859.4°60.0°
H26C24C25H29179.4°179.9°
H26C24C25H3060.7°60.1°
H27C24C25H2859.4°59.9°
H27C24C25H2960.6°60.0°
H27C24C25H30179.4°180.0°
H28C25H29H30120.0°120.1°
H33C15C16H3576.6°NaN°
H33C15C16H3642.5°60.0°
H34C15C16H3542.8°60.0°
H34C15C16H36161.9°180.0°
H35C16C17H37175.7°180.0°
H35C16C17H3864.0°60.0°
H36C16C17H3756.6°60.0°
H36C16C17H38176.9°180.0°
H37C17C18H3960.1°60.0°
H37C17C18H4059.9°180.0°
H37C17C18H41179.9°60.0°
H38C17C18H3960.1°60.0°
H38C17C18H40179.9°60.0°
H38C17C18H4159.9°180.0°
H39C18H40H41120.0°120.0°

225158

PDB entries from 2024-09-18

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