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VEJ

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C11N2doub1.32Å1.34ÅAromatic
C11C12sing1.38Å1.38ÅAromatic
N2C10sing1.32Å1.34ÅAromatic
C12C13doub1.39Å1.38ÅAromatic
C10C9doub1.38Å1.39ÅAromatic
C13C9sing1.39Å1.39ÅAromatic
C9C3sing1.51Å1.52Å
CC1sing1.53Å1.54Å
O1C4doub1.21Å1.22Å
OC2doub1.21Å1.22Å
C2C1sing1.51Å1.51Å
C2Nsing1.35Å1.37Å
C3Nsing1.47Å1.49Å
C3C4sing1.51Å1.54Å
C15C16doub1.38Å1.38ÅAromatic
C15C14sing1.39Å1.39ÅAromatic
NC14sing1.40Å1.44Å
C4N1sing1.35Å1.33Å
C16C17sing1.38Å1.39ÅAromatic
C14C19doub1.39Å1.39ÅAromatic
O2C8sing1.43Å1.42Å
O2C7sing1.43Å1.41Å
N1C5sing1.46Å1.46Å
C5C6sing1.53Å1.52Å
C6C7sing1.53Å1.51Å
C21C20sing1.53Å1.53Å
C17C18doub1.38Å1.39ÅAromatic
C17C20sing1.51Å1.53Å
C19C18sing1.38Å1.39ÅAromatic
C20C23sing1.53Å1.53Å
C20C22sing1.53Å1.54Å
N1H1sing0.97Å1.00Å
C5H2sing1.09Å1.10Å
C5H3sing1.09Å1.10Å
C6H4sing1.09Å1.10Å
C6H5sing1.09Å1.10Å
C7H6sing1.09Å1.10Å
C7H7sing1.09Å1.10Å
C8H8sing1.09Å1.10Å
C8H9sing1.09Å1.10Å
C8H10sing1.09Å1.10Å
C10H11sing1.08Å1.08Å
C13H12sing1.08Å1.08Å
C15H13sing1.08Å1.08Å
C21H14sing1.09Å1.10Å
C21H15sing1.09Å1.10Å
C21H16sing1.09Å1.10Å
C22H17sing1.09Å1.10Å
C22H18sing1.09Å1.10Å
C22H19sing1.09Å1.10Å
C3H20sing1.09Å1.10Å
C12H21sing1.08Å1.08Å
C11H22sing1.08Å1.08Å
C1H23sing1.09Å1.10Å
C1H24sing1.09Å1.10Å
CH25sing1.09Å1.10Å
CH26sing1.09Å1.10Å
CH27sing1.09Å1.10Å
C19H28sing1.08Å1.08Å
C18H29sing1.08Å1.08Å
C23H30sing1.09Å1.10Å
C23H31sing1.09Å1.10Å
C23H32sing1.09Å1.10Å
C16H33sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
N2C11C12123.4°120.8°
C11N2C10117.2°121.8°
N2C11H22118.3°119.6°
C11C12C13118.2°119.2°
C11C12H21120.9°120.4°
C12C11H22118.3°119.6°
N2C10C9124.3°120.7°
N2C10H11117.9°119.6°
C12C13C9120.1°118.4°
C12C13H12119.9°120.8°
C13C12H21120.9°120.5°
C10C9C13116.8°119.2°
C10C9C3122.0°120.4°
C9C10H11117.9°119.7°
C13C9C3120.7°120.4°
C9C13H12119.9°120.8°
C9C3N116.6°109.5°
C9C3C4111.7°109.5°
C9C3H20104.1°109.5°
CC1C2116.5°109.5°
CC1H23107.7°109.5°
CC1H24107.7°109.5°
C1CH25109.5°109.5°
C1CH26109.5°109.5°
C1CH27109.5°109.5°
O1C4C3120.2°120.0°
O1C4N1122.1°120.0°
OC2C1119.2°119.9°
OC2N121.7°120.1°
C1C2N119.0°120.0°
C2C1H23107.7°109.4°
C2C1H24107.7°109.4°
C2NC3119.9°120.0°
C2NC14122.0°120.0°
NC3C4114.3°109.5°
C3NC14118.0°120.0°
NC3H20104.4°109.5°
C3C4N1117.7°120.0°
C4C3H20104.0°109.5°
C16C15C14120.2°120.0°
C15C16C17121.2°120.1°
C16C15H13119.9°120.0°
C15C16H33119.4°120.0°
C15C14N120.4°120.1°
C15C14C19119.1°119.9°
C14C15H13119.9°120.1°
NC14C19120.4°120.1°
C4N1C5122.5°120.0°
C4N1H1118.8°120.0°
C16C17C18118.2°120.1°
C16C17C20121.1°119.9°
C17C16H33119.4°119.9°
C14C19C18120.1°119.9°
C14C19H28119.9°120.1°
C8O2C7111.9°114.0°
O2C8H8109.5°109.5°
O2C8H9109.5°109.5°
O2C8H10109.4°109.5°
O2C7C6113.7°109.4°
O2C7H6108.4°109.5°
O2C7H7108.4°109.5°
N1C5C6112.4°109.5°
C5N1H1118.8°120.0°
N1C5H2108.7°109.5°
N1C5H3108.7°109.5°
C5C6C7114.5°109.5°
C6C5H2108.7°109.4°
C6C5H3108.8°109.4°
C5C6H4108.2°109.5°
C5C6H5108.2°109.4°
C7C6H4108.2°109.5°
C7C6H5108.2°109.5°
C6C7H6108.4°109.5°
C6C7H7108.4°109.5°
C21C20C17112.4°109.5°
C21C20C23107.3°109.5°
C21C20C22107.8°109.5°
C20C21H14109.5°109.5°
C20C21H15109.4°109.5°
C20C21H16109.5°109.5°
C18C17C20120.5°120.0°
C17C18C19121.1°120.1°
C17C18H29119.4°119.9°
C17C20C23108.7°109.5°
C17C20C22111.1°109.5°
C18C19H28119.9°120.0°
C19C18H29119.4°120.0°
C23C20C22109.4°109.4°
C20C23H30109.5°109.4°
C20C23H31109.5°109.4°
C20C23H32109.5°109.5°
C20C22H17109.5°109.5°
C20C22H18109.5°109.5°
C20C22H19109.5°109.5°
H2C5H3109.5°109.5°
H4C6H5109.5°109.5°
H6C7H7109.4°109.5°
H8C8H9109.5°109.5°
H8C8H10109.5°109.4°
H9C8H10109.5°109.4°
H14C21H15109.5°109.5°
H14C21H16109.5°109.4°
H15C21H16109.5°109.5°
H17C22H18109.5°109.5°
H17C22H19109.5°109.4°
H18C22H19109.4°109.5°
H23C1H24109.4°109.5°
H25CH26109.5°109.5°
H25CH27109.5°109.4°
H26CH27109.5°109.4°
H30C23H31109.5°109.5°
H30C23H32109.5°109.5°
H31C23H32109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
N2C11C12H22180.0°179.5°
N2C11C12C130.6°0.7°
C11N2C10C91.6°0.0°
C11N2C10H11178.4°179.7°
N2C11C12H21179.4°179.7°
C12C11N2C100.1°0.5°
C11C12C13H21180.0°179.5°
C11C12C13C90.1°0.5°
C11C12C13H12179.9°179.5°
N2C10C9H11180.0°179.7°
N2C10C9C132.2°0.2°
N2C10C9C3170.3°179.8°
C10N2C11H22179.9°180.0°
C12C13C9C101.4°0.0°
C12C13C9H12180.0°180.0°
C12C13C9C3171.2°180.0°
C13C12C11H22179.4°179.8°
C10C9C13C3172.6°180.0°
C10C9C3N57.0°56.3°
C10C9C3C477.0°63.7°
C10C9C13H12178.6°180.0°
C10C9C3H20171.4°176.3°
C13C9C3N130.8°123.7°
C13C9C3C495.2°116.3°
C13C9C10H11177.8°180.0°
C13C9C3H2016.4°3.7°
C9C13C12H21179.9°180.0°
C9C3C4O154.5°120.0°
C9C3NC241.6°173.1°
C9C3NC4132.9°120.0°
C9C3NH20114.2°120.0°
C9C3C4H20111.7°120.0°
C9C3NC14141.6°6.9°
C9C3C4N1123.1°60.0°
C3C9C10H119.7°0.0°
C3C9C13H128.8°0.0°
CC1C2O108.2°5.6°
CC1C2H23121.0°120.0°
CC1C2H24121.0°120.0°
CC1C2N76.1°174.4°
CC1H23H24116.8°120.1°
C1CH25H26120.0°120.1°
C1CH25H27120.0°120.0°
C1CH26H27120.0°120.0°
O1C4C3N80.7°0.1°
O1C4C3N1177.6°180.0°
O1C4N1C52.6°0.0°
O1C4N1H1177.4°179.8°
O1C4C3H20166.1°120.0°
OC2C1N175.7°179.9°
OC2NC38.4°4.5°
OC2NC14168.4°175.5°
OC2C1H2312.8°125.6°
OC2C1H24130.8°114.4°
C1C2NC3176.1°175.5°
C1C2NC147.2°4.4°
C2C1H23H24116.8°119.9°
C2C1CH25180.0°60.0°
C2C1CH2660.0°60.0°
C2C1CH2760.0°180.0°
C2NC3C14176.8°180.0°
C2NC3C4174.5°67.0°
C2NC14C1599.8°69.8°
C2NC14C1983.2°110.2°
C2NC3H2072.6°53.0°
NC2C1H23162.9°54.4°
NC2C1H2444.9°65.5°
NC3C4H20113.2°120.0°
C3NC14C1583.4°110.2°
NC3C4N1101.7°180.0°
C3NC14C1993.6°69.8°
C4C3NC148.7°113.1°
C3C4N1C5179.9°180.0°
C3C4N1H10.1°0.2°
C16C15C14H13180.0°179.8°
C16C15C14N175.7°180.0°
C15C16C17H33180.0°180.0°
C16C15C14C191.3°0.1°
C15C16C17C181.2°0.0°
C15C16C17C20173.9°180.0°
C15C14NC19177.0°180.0°
C14C15C16C170.3°0.0°
C15C14C19C180.7°0.0°
C15C14C19H28179.3°180.0°
C14C15C16H33179.7°180.0°
NC14C19C18176.3°180.0°
NC14C15H134.3°0.3°
C14NC3H20104.2°126.9°
NC14C19H283.7°0.1°
C4N1C5H1180.0°179.8°
C4N1C5C664.2°179.7°
C4N1C5H256.2°60.3°
C4N1C5H3175.3°59.8°
N1C4C3H2011.4°60.0°
C16C17C20C2113.1°0.0°
C16C17C18C20175.1°179.9°
C16C17C18C191.8°0.1°
C16C17C20C23105.5°120.0°
C16C17C20C22134.0°120.0°
C17C16C15H13179.6°179.7°
C16C17C18H29178.2°180.0°
C14C19C18C170.8°0.1°
C14C19C18H28180.0°180.0°
C19C14C15H13178.6°179.7°
C14C19C18H29179.2°180.0°
C8O2C7C6158.3°180.0°
C8O2C7H637.7°60.0°
C8O2C7H781.0°60.0°
O2C8H8H9120.0°120.1°
O2C8H8H10120.0°120.0°
O2C8H9H10120.0°120.0°
O2C7C6C554.6°180.0°
O2C7C6H6120.6°120.0°
O2C7C6H7120.6°120.0°
O2C7C6H4175.3°60.0°
O2C7C6H566.2°60.0°
O2C7H6H7118.0°120.0°
C7O2C8H8180.0°180.0°
C7O2C8H960.0°60.0°
C7O2C8H1060.0°60.0°
N1C5C6H2120.4°120.0°
N1C5C6H3120.5°120.0°
N1C5C6C7175.7°180.0°
N1C5H2H3118.7°120.0°
N1C5C6H463.6°60.0°
N1C5C6H555.0°60.0°
C5C6C7H4120.7°120.0°
C5C6C7H5120.7°119.9°
C6C5N1H1115.8°0.1°
C6C5H2H3118.7°120.0°
C5C6H4H5117.7°120.0°
C5C6C7H6175.2°60.0°
C5C6C7H766.1°60.1°
C7C6C5H255.3°60.0°
C7C6C5H363.8°60.0°
C7C6H4H5117.7°120.0°
C6C7H6H7118.1°120.0°
C21C20C17C18171.9°180.0°
C21C20C17C23118.6°120.0°
C21C20C17C22120.9°120.0°
C21C20C23C22116.7°120.0°
C20C21H14H15120.0°120.1°
C20C21H14H16120.0°120.0°
C20C21H15H16120.0°120.0°
C21C20C22H17180.0°180.0°
C21C20C22H1860.0°60.0°
C21C20C22H1960.0°60.0°
C21C20C23H30180.0°60.0°
C21C20C23H3160.0°59.9°
C21C20C23H3260.0°180.0°
C17C18C19H29180.0°179.9°
C18C17C20C2369.5°59.9°
C18C17C20C2251.0°60.0°
C17C18C19H28179.1°179.9°
C18C17C16H33178.7°179.9°
C20C17C18C19173.3°180.0°
C17C20C23C22121.5°120.0°
C17C20C21H14180.0°59.9°
C17C20C21H1560.0°180.0°
C17C20C21H1660.0°60.0°
C17C20C22H1756.4°60.0°
C17C20C22H1863.6°180.0°
C17C20C22H19176.4°60.0°
C20C17C18H296.7°0.1°
C17C20C23H3058.2°60.1°
C17C20C23H31178.2°180.0°
C17C20C23H3261.8°60.0°
C20C17C16H336.1°0.0°
C23C20C21H1460.5°180.0°
C23C20C21H15179.5°60.0°
C23C20C21H1659.5°60.0°
C23C20C22H1763.6°60.0°
C23C20C22H18176.3°60.0°
C23C20C22H1956.4°180.0°
C20C23H30H31120.0°119.9°
C20C23H30H32120.0°120.0°
C20C23H31H32120.0°120.0°
C22C20C21H1457.2°60.1°
C22C20C21H1562.8°60.0°
C22C20C21H16177.2°180.0°
C20C22H17H18120.0°120.0°
C20C22H17H19120.0°120.0°
C20C22H18H19120.0°120.0°
C22C20C23H3063.3°180.0°
C22C20C23H3156.7°60.0°
C22C20C23H32176.7°60.0°
H1N1C5H2123.8°119.9°
H1N1C5H34.7°120.0°
H2C5C6H4176.0°180.0°
H2C5C6H565.4°60.0°
H3C5C6H456.9°60.0°
H3C5C6H5175.4°180.0°
H4C6C7H664.1°180.0°
H4C6C7H754.7°60.0°
H5C6C7H654.5°60.0°
H5C6C7H7173.2°180.0°
H8C8H9H10120.0°119.9°
H12C13C12H210.1°0.0°
H13C15C16H330.3°0.2°
H14C21H15H16120.0°119.9°
H17C22H18H19120.0°120.0°
H21C12C11H220.6°0.2°
H23C1CH2559.0°180.0°
H23C1CH2661.0°59.9°
H23C1CH27179.0°60.0°
H24C1CH2559.0°59.9°
H24C1CH26179.0°180.0°
H24C1CH2761.0°60.0°
H25CH26H27120.0°119.9°
H28C19C18H290.9°0.0°
H30C23H31H32120.0°120.1°

222926

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