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C15

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C1C2sing1.52Å1.54Å
C1S1sing1.77Å1.81Å
C1H1C1sing1.09Å1.10Å
C1H1C2sing1.09Å1.10Å
C2C3sing1.52Å1.54Å
C2H2C1sing1.10Å1.10Å
C2H2C2sing1.10Å1.10Å
C3N1sing1.54Å1.46Å
C3H3C1sing1.09Å1.10Å
C3H3C2sing1.09Å1.10Å
C5C6sing1.52Å1.50Å
C5H5C1sing1.09Å1.10Å
C5H5C2sing1.09Å1.10Å
C5H5C3sing1.09Å1.10Å
C6C7sing1.53Å1.51Å
C6H6C1sing1.10Å1.10Å
C6H6C2sing1.10Å1.10Å
C7C8sing1.53Å1.51Å
C7H7C1sing1.10Å1.10Å
C7H7C2sing1.10Å1.10Å
C8C9sing1.53Å1.51Å
C8H8C1sing1.10Å1.10Å
C8H8C2sing1.10Å1.10Å
N1C1Nsing1.54Å38.02Å
N1C2Nsing1.54Å38.02Å
N1C16sing1.48Å1.45Å
C1NHCN1sing1.09Å0.00Å
C1NHCN2sing1.09Å0.00Å
C1NHCN3sing1.09Å0.00Å
C2NHCN4sing1.09Å0.00Å
C2NHCN5sing1.09Å0.00Å
C2NHCN6sing1.09Å0.00Å
C9C10sing1.53Å1.51Å
C9H9C1sing1.10Å1.10Å
C9H9C2sing1.10Å1.10Å
C10C11sing1.53Å1.51Å
C10H101sing1.10Å1.10Å
C10H102sing1.10Å1.10Å
C11C12sing1.53Å1.51Å
C11H111sing1.10Å1.10Å
C11H112sing1.10Å1.10Å
C12C13sing1.53Å1.52Å
C12H121sing1.09Å1.10Å
C12H122sing1.10Å1.10Å
C13C14sing1.53Å1.53Å
C13H131sing1.10Å1.10Å
C13H132sing1.10Å1.10Å
C14C15sing1.53Å1.52Å
C14H141sing1.10Å1.10Å
C14H142sing1.10Å1.10Å
C15C16sing1.52Å1.52Å
C15H151sing1.10Å1.10Å
C15H152sing1.10Å1.10Å
C16H161sing1.09Å1.10Å
C16H162sing1.09Å1.10Å
S1O1Sdoub1.45Å1.43Å
S1O2Sdoub1.45Å1.42Å
S1O3Ssing1.63Å1.76Å
O3SH3Ssing0.99Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C2C1S1114.6°111.2°
C2C1H1C1107.8°111.3°
C2C1H1C2106.6°111.9°
C1C2C3111.8°113.4°
C1C2H2C1108.7°109.1°
C1C2H2C2108.1°109.7°
S1C1H1C1107.8°106.8°
S1C1H1C2106.6°106.4°
C1S1O1S106.6°108.9°
C1S1O2S112.7°108.8°
C1S1O3S109.7°97.4°
H1C1C1H1C2113.6°109.0°
C3C2H2C1108.7°108.3°
C3C2H2C2108.2°110.0°
C2C3N1113.2°110.7°
C2C3H3C1108.2°112.2°
C2C3H3C2107.4°110.9°
H2C1C2H2C2111.4°106.2°
N1C3H3C1108.3°107.1°
N1C3H3C2107.4°106.5°
C3N1C1N81.4°108.0°
C3N1C2N81.4°108.0°
C3N1C16117.8°110.9°
H3C1C3H3C2112.4°109.3°
C6C5H5C1109.5°111.0°
C6C5H5C2109.5°111.0°
C6C5H5C3109.5°110.3°
C5C6C7106.9°111.5°
C5C6H6C1110.4°109.1°
C5C6H6C2110.9°109.1°
H5C1C5H5C2109.4°108.3°
H5C1C5H5C3109.5°108.1°
H5C2C5H5C3109.5°108.1°
C7C6H6C1110.3°109.9°
C7C6H6C2110.9°109.9°
C6C7C8113.0°111.3°
C6C7H7C1108.3°109.5°
C6C7H7C2107.5°109.6°
H6C1C6H6C2107.5°107.2°
C8C7H7C1108.3°109.6°
C8C7H7C2107.5°109.6°
C7C8C9103.7°111.3°
C7C8H8C1111.4°109.5°
C7C8H8C2112.7°109.6°
H7C1C7H7C2112.3°107.2°
C9C8H8C1111.4°109.6°
C9C8H8C2112.6°109.5°
C8C9C10110.8°111.2°
C8C9H9C1109.0°109.0°
C8C9H9C2108.7°109.6°
H8C1C8H8C2105.1°107.2°
C1NN1C2N0.0°108.0°
C1NN1C1673.4°110.9°
N1C1NHCN190.0°107.8°
N1C1NHCN290.0°107.8°
N1C1NHCN390.0°107.8°
C2NN1C1673.4°110.9°
N1C2NHCN490.0°107.8°
N1C2NHCN590.0°107.8°
N1C2NHCN690.0°107.8°
N1C16C15112.1°110.7°
N1C16H161108.6°106.6°
N1C16H162108.0°107.2°
HCN1C1NHCN290.0°111.1°
HCN1C1NHCN390.0°111.1°
HCN2C1NHCN390.0°111.0°
HCN4C2NHCN590.0°111.1°
HCN4C2NHCN690.0°111.1°
HCN5C2NHCN690.0°111.1°
C10C9H9C1109.0°110.1°
C10C9H9C2108.7°109.6°
C9C10C11107.9°113.4°
C9C10H101110.0°109.8°
C9C10H102110.3°109.1°
H9C1C9H9C2110.5°107.3°
C11C10H101110.0°109.6°
C11C10H102110.4°108.1°
C10C11C12108.7°113.4°
C10C11H111109.7°108.1°
C10C11H112109.9°109.6°
H101C10H102108.3°106.7°
C12C11H111109.8°109.1°
C12C11H112109.9°109.7°
C11C12C13111.2°111.1°
C11C12H121108.9°109.6°
C11C12H122108.6°109.6°
H111C11H112108.9°106.8°
C13C12H121108.9°109.5°
C13C12H122108.5°109.5°
C12C13C14109.0°113.4°
C12C13H131109.6°109.9°
C12C13H132109.7°109.1°
H121C12H122110.8°107.4°
C14C13H131109.6°110.1°
C14C13H132109.7°107.9°
C13C14C15110.8°115.8°
C13C14H141109.0°108.5°
C13C14H142108.7°108.8°
H131C13H132109.1°106.2°
C15C14H141109.0°109.3°
C15C14H142108.7°108.2°
C14C15C16112.0°115.8°
C14C15H151108.6°108.1°
C14C15H152108.0°109.3°
H141C14H142110.5°105.8°
C16C15H151108.6°109.0°
C16C15H152108.1°108.5°
C15C16H161108.6°110.6°
C15C16H162108.0°112.7°
H151C15H152111.5°105.7°
H161C16H162111.6°108.9°
O1SS1O2S108.3°121.6°
O1SS1O3S105.5°108.8°
O2SS1O3S113.6°108.7°
S1O3SH3S109.5°115.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C2C1S1H1C1120.0°121.7°
C2C1S1H1C2117.7°122.1°
C2C1H1C1H1C2117.9°123.9°
C1C2C3H2C1120.0°121.2°
C1C2C3H2C2119.0°123.1°
C1C2H2C1H2C2119.0°118.1°
C1C2C3N1165.5°179.5°
C1C2C3H3C145.5°60.0°
C1C2C3H3C276.1°62.5°
C2C1S1O1S158.4°60.0°
C2C1S1O2S39.8°74.5°
C2C1S1O3S87.8°172.8°
S1C1H1C1H1C2117.9°114.5°
S1C1C2C3177.3°179.0°
S1C1C2H2C162.7°58.2°
S1C1C2H2C258.3°57.7°
C1S1O1SO2S121.5°127.5°
C1S1O1SO3S116.6°105.1°
C1S1O2SO3S125.6°105.0°
C1S1O3SH3S175.3°71.1°
H1C1C1C2C362.7°60.0°
H1C1C1C2H2C157.3°60.8°
H1C1C1C2H2C2178.3°176.7°
H1C1C1S1O1S81.6°178.3°
H1C1C1S1O2S159.8°47.2°
H1C1C1S1O3S32.2°65.5°
H1C2C1C2C359.5°62.2°
H1C2C1C2H2C1179.6°177.0°
H1C2C1C2H2C259.4°61.1°
H1C2C1S1O1S40.7°62.1°
H1C2C1S1O2S78.0°163.4°
H1C2C1S1O3S154.4°50.7°
C3C2H2C1H2C2119.0°118.1°
C2C3N1H3C1120.0°122.5°
C2C3N1H3C2118.4°120.6°
C2C3H3C1H3C2118.4°123.4°
C2C3N1C1N76.2°57.5°
C2C3N1C2N76.2°174.1°
C2C3N1C1610.2°64.2°
H2C1C2C3N174.5°59.3°
H2C1C2C3H3C1165.5°178.8°
H2C1C2C3H3C243.9°58.7°
H2C2C2C3N146.5°56.3°
H2C2C2C3H3C173.5°63.2°
H2C2C2C3H3C2164.9°174.3°
N1C3H3C1H3C2118.5°115.0°
C3N1C1NC2N90.0°116.6°
C3N1C1NC16122.5°121.7°
C3N1C2NC16122.5°121.7°
C3N1C1NHCN190.0°106.8°
C3N1C1NHCN290.0°13.3°
C3N1C1NHCN390.0°133.2°
C3N1C2NHCN490.0°71.6°
C3N1C2NHCN590.0°168.4°
C3N1C2NHCN690.0°48.4°
C3N1C16C15137.6°179.7°
C3N1C16H161102.4°60.0°
C3N1C16H16218.7°56.4°
H3C1C3N1C1N163.8°180.0°
H3C1C3N1C2N163.8°63.4°
H3C1C3N1C16130.2°58.3°
H3C2C3N1C1N42.1°63.1°
H3C2C3N1C2N42.1°53.5°
H3C2C3N1C16108.2°175.2°
C6C5H5C1H5C2120.0°122.0°
C6C5H5C1H5C3120.0°121.1°
C6C5H5C2H5C3120.0°121.1°
C5C6C7H6C1120.0°121.1°
C5C6C7H6C2121.0°121.1°
C5C6H6C1H6C2121.0°118.1°
C5C6C7C8111.9°178.7°
C5C6C7H7C1128.1°60.0°
C5C6C7H7C26.6°57.3°
H5C1C5H5C2H5C3120.0°116.9°
H5C1C5C6C74.4°60.2°
H5C1C5C6H6C1124.4°61.4°
H5C1C5C6H6C2116.6°178.2°
H5C2C5C6C7124.4°60.3°
H5C2C5C6H6C1115.6°178.2°
H5C2C5C6H6C23.4°61.3°
H5C3C5C6C7115.6°180.0°
H5C3C5C6H6C14.4°58.4°
H5C3C5C6H6C2123.4°58.5°
C7C6H6C1H6C2121.1°119.4°
C6C7C8H7C1120.0°121.3°
C6C7C8H7C2118.5°121.4°
C6C7H7C1H7C2118.5°118.8°
C6C7C8C9178.2°178.6°
C6C7C8H8C161.8°60.0°
C6C7C8H8C256.1°57.3°
H6C1C6C7C88.1°60.2°
H6C1C6C7H7C1111.9°61.1°
H6C1C6C7H7C2126.6°178.4°
H6C2C6C7C8127.1°57.5°
H6C2C6C7H7C17.1°178.9°
H6C2C6C7H7C2114.4°63.9°
C8C7H7C1H7C2118.5°118.9°
C7C8C9H8C1120.0°121.3°
C7C8C9H8C2122.1°121.4°
C7C8H8C1H8C2122.3°118.9°
C7C8C9C10163.9°178.4°
C7C8C9H9C176.1°60.1°
C7C8C9H9C244.4°57.1°
H7C1C7C8C958.2°57.3°
H7C1C7C8H8C1178.2°178.7°
H7C1C7C8H8C263.9°64.0°
H7C2C7C8C963.4°60.0°
H7C2C7C8H8C156.6°61.3°
H7C2C7C8H8C2174.5°178.7°
C9C8H8C1H8C2122.3°118.8°
C8C9C10H9C1120.0°120.9°
C8C9C10H9C2119.4°121.3°
C8C9H9C1H9C2119.4°118.6°
C8C9C10C11111.3°177.0°
C8C9C10H1018.7°60.0°
C8C9C10H102128.1°56.5°
H8C1C8C9C1043.9°57.1°
H8C1C8C9H9C1163.9°178.7°
H8C1C8C9H9C275.6°64.2°
H8C2C8C9C1074.0°60.2°
H8C2C8C9H9C146.0°61.3°
H8C2C8C9H9C2166.5°178.5°
C1NN1C2NC1690.0°121.7°
N1C1NHCN1HCN290.0°117.9°
N1C1NHCN1HCN390.0°118.0°
N1C1NHCN2HCN390.0°117.9°
C1NN1C2NHCN490.0°171.8°
C1NN1C2NHCN590.0°51.8°
C1NN1C2NHCN690.0°68.2°
C1NN1C16C15151.8°60.3°
C1NN1C16H16131.9°60.0°
C1NN1C16H16289.3°176.4°
C2NN1C1NHCN190.0°136.6°
C2NN1C1NHCN290.0°103.4°
C2NN1C1NHCN390.0°16.6°
N1C2NHCN4HCN590.0°117.9°
N1C2NHCN4HCN690.0°117.9°
N1C2NHCN5HCN690.0°117.9°
C2NN1C16C15151.8°59.7°
C2NN1C16H16131.9°179.9°
C2NN1C16H16289.3°63.6°
C16N1C1NHCN190.0°14.9°
C16N1C1NHCN290.0°134.9°
C16N1C1NHCN390.0°105.1°
C16N1C2NHCN490.0°50.1°
C16N1C2NHCN590.0°69.8°
C16N1C2NHCN690.0°170.2°
N1C16C15C14105.2°177.8°
N1C16C15H161120.0°117.8°
N1C16C15H162118.9°120.0°
N1C16C15H151134.8°60.1°
N1C16C15H15213.7°54.6°
N1C16H161H162118.9°115.3°
HCN1C1NHCN2HCN390.0°124.2°
HCN4C2NHCN5HCN690.0°124.2°
C10C9H9C1H9C2119.5°119.2°
C9C10C11H101120.0°123.1°
C9C10C11H102120.6°121.0°
C9C10H101H102120.6°118.0°
C9C10C11C12163.9°179.0°
C9C10C11H11176.1°60.0°
C9C10C11H11243.6°56.0°
H9C1C9C10C11128.7°62.0°
H9C1C9C10H101111.3°60.9°
H9C1C9C10H1028.1°177.5°
H9C2C9C10C118.2°55.8°
H9C2C9C10H101128.2°178.7°
H9C2C9C10H102112.5°64.7°
C11C10H101H102120.7°116.8°
C10C11C12H111120.0°120.5°
C10C11C12H112120.3°122.9°
C10C11H111H112120.3°117.8°
C10C11C12C13107.6°178.9°
C10C11C12H121132.4°60.0°
C10C11C12H12211.7°57.7°
H101C10C11C1243.9°55.9°
H101C10C11H111163.9°176.9°
H101C10C11H11276.4°67.1°
H102C10C11C1275.5°60.0°
H102C10C11H11144.5°61.0°
H102C10C11H112164.2°177.0°
C12C11H111H112120.3°118.5°
C11C12C13H121120.0°121.2°
C11C12C13H122119.3°121.3°
C11C12H121H122119.3°119.0°
C11C12C13C14179.9°176.3°
C11C12C13H13159.9°60.0°
C11C12C13H13259.9°56.0°
H111C11C12C1312.4°58.4°
H111C11C12H121107.6°179.5°
H111C11C12H122131.7°62.8°
H112C11C12C13132.1°58.2°
H112C11C12H12112.1°62.9°
H112C11C12H122108.6°179.4°
C13C12H121H122119.3°118.9°
C12C13C14H131120.0°123.6°
C12C13C14H132120.2°121.0°
C12C13H131H132120.2°117.8°
C12C13C14C15145.1°56.7°
C12C13C14H14125.1°180.0°
C12C13C14H14295.4°65.3°
H121C12C13C1460.1°62.5°
H121C12C13H131179.9°61.2°
H121C12C13H13260.1°177.2°
H122C12C13C1460.6°55.0°
H122C12C13H13159.4°178.7°
H122C12C13H132179.2°65.2°
C14C13H131H132120.2°116.5°
C13C14C15H141120.0°122.8°
C13C14C15H142119.5°122.4°
C13C14H141H142119.5°116.6°
C13C14C15C16133.1°57.4°
C13C14C15H15113.1°180.0°
C13C14C15H152108.0°65.4°
H131C13C14C1594.9°66.9°
H131C13C14H141145.1°56.4°
H131C13C14H14224.6°171.1°
H132C13C14C1524.9°177.7°
H132C13C14H14195.1°59.1°
H132C13C14H142144.4°55.6°
C15C14H141H142119.4°116.3°
C14C15C16H151120.0°122.1°
C14C15C16H152118.9°123.3°
C14C15H151H152118.9°116.9°
C14C15C16H161134.8°60.0°
C14C15C16H16213.7°62.1°
H141C14C15C16106.9°65.4°
H141C14C15H151133.1°57.2°
H141C14C15H15212.0°171.7°
H142C14C15C1613.6°179.8°
H142C14C15H151106.4°57.6°
H142C14C15H152132.5°56.9°
C16C15H151H152119.0°116.5°
C15C16H161H162118.9°124.4°
H151C15C16H16114.8°178.0°
H151C15C16H162106.3°59.9°
H152C15C16H161106.3°63.3°
H152C15C16H162132.6°174.6°
O1SS1O2SO3S116.8°127.4°
O1SS1O3SH3S70.2°41.8°
O2SS1O3SH3S48.2°176.1°

222415

PDB entries from 2024-07-10

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