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MN0

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C1C2sing1.51Å1.55Å
C2O2sing1.43Å1.46Å
O2C12sing1.43Å1.47Å
C3C2sing1.53Å1.55Å
C3H32sing1.09Å1.10Å
C3H31sing1.09Å1.10Å
C4C3sing1.53Å1.54Å
C4H4sing1.09Å1.10Å
O4C4sing1.43Å1.43Å
O4HO4sing0.97Å0.95Å
C5C4sing1.53Å1.52Å
C5C6sing1.53Å1.54Å
C5H5sing1.09Å1.10Å
N5C5sing1.47Å1.48Å
N5HN5sing0.97Å1.00Å
C6C7sing1.53Å1.53Å
C6O6sing1.43Å1.47Å
C6H6sing1.09Å1.10Å
O6C2sing1.43Å1.46Å
C7O7sing1.43Å1.43Å
C7C8sing1.53Å1.54Å
C7H7sing1.09Å1.10Å
O7HO7sing0.97Å0.95Å
C8H8sing1.09Å1.10Å
O8C8sing1.43Å1.43Å
O8HO8sing0.97Å0.95Å
C9C8sing1.53Å1.52Å
C9O9sing1.43Å1.43Å
C9H92sing1.09Å1.10Å
C9H91sing1.09Å1.10Å
O9HO9sing0.97Å0.95Å
C10N5sing1.35Å1.34Å
C10O10doub1.21Å1.23Å
C11C10sing1.51Å1.53Å
C11H111sing1.09Å1.10Å
O11C11sing1.43Å1.36Å
C12H12sing1.09Å1.10Å
C12H12Asing1.09Å1.10Å
C12H12Bsing1.09Å1.10Å
O1BC1sing1.34Å1.25Å
O1AC1doub1.21Å1.25Å
C11H113sing1.09Å1.10Å
O11H20sing0.97Å0.95Å
O1BHO1Bsing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C1C2O2108.7°109.5°
C1C2C3109.3°109.5°
C1C2O6112.3°109.5°
C2C1O1B117.5°120.0°
C2C1O1A117.9°120.0°
C2O2C12117.5°114.0°
O2C2C3108.0°109.5°
O2C2O6109.5°109.5°
O2C12H12109.5°109.5°
O2C12H12A109.5°109.5°
O2C12H12B109.5°109.5°
C2C3H32108.5°109.5°
C2C3H31108.5°109.6°
C2C3C4112.4°109.1°
C3C2O6108.9°109.5°
H32C3H31110.4°109.5°
H32C3C4108.5°109.5°
H31C3C4108.5°109.6°
C3C4H4106.9°109.5°
C3C4O4110.5°109.5°
C3C4C5111.9°109.0°
H4C4O4110.0°109.5°
H4C4C5108.5°109.6°
C4O4HO4109.5°114.0°
O4C4C5109.0°109.7°
C4C5C6109.8°109.2°
C4C5H5112.0°109.6°
C4C5N5107.8°109.5°
C6C5H5105.6°109.5°
C6C5N5113.9°109.5°
C5C6C7119.8°109.5°
C5C6O6108.6°109.4°
C5C6H6101.2°109.4°
H5C5N5107.7°109.6°
C5N5HN5118.5°120.0°
C5N5C10122.9°120.0°
HN5N5C10118.6°120.0°
C7C6O6103.3°109.5°
C7C6H6106.6°109.5°
C6C7O7110.3°109.5°
C6C7C8110.6°109.5°
C6C7H7108.1°109.5°
O6C6H6118.3°109.5°
C6O6C2116.8°114.1°
O7C7C8109.5°109.5°
O7C7H7109.4°109.5°
C7O7HO7109.5°114.0°
C8C7H7108.9°109.5°
C7C8H8108.1°109.5°
C7C8O8109.4°109.5°
C7C8C9111.3°109.5°
H8C8O8110.4°109.4°
H8C8C9108.5°109.5°
C8O8HO8109.5°114.0°
O8C8C9109.1°109.5°
C8C9O9108.8°109.5°
C8C9H92109.7°109.5°
C8C9H91109.7°109.5°
O9C9H92109.7°109.4°
O9C9H91109.7°109.5°
C9O9HO9109.5°114.0°
H92C9H91109.2°109.5°
N5C10O10123.7°120.1°
N5C10C11118.3°120.0°
O10C10C11118.0°120.0°
C10C11H111106.7°109.4°
C10C11O11118.1°109.5°
C10C11H113106.7°109.5°
H111C11O11106.7°109.5°
H111C11H113112.1°109.5°
O11C11H113106.7°109.5°
C11O11H20109.5°114.0°
H12C12H12A109.4°109.5°
H12C12H12B109.4°109.4°
H12AC12H12B109.5°109.5°
O1BC1O1A124.6°120.0°
C1O1BHO1B109.5°117.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C1C2O2C3118.5°120.0°
C1C2O2O6123.0°120.0°
C1C2O2C12104.0°175.1°
C1C2C3O6123.0°120.0°
C1C2C3H32166.5°177.7°
C1C2C3H3146.5°57.6°
C1C2C3C473.5°62.4°
C1C2O6C665.0°58.8°
C2C1O1BO1A179.3°179.7°
C2C1O1BHO1B179.3°180.0°
O2C2C3O6118.8°120.0°
O2C2C3H3248.4°57.7°
O2C2C3H3171.6°62.4°
O2C2C3C4168.4°177.6°
O2C2O6C6174.2°178.8°
C2O2C12H12180.0°174.3°
C2O2C12H12A60.0°65.7°
C2O2C12H12B60.0°54.4°
O2C2C1O1B70.8°175.7°
O2C2C1O1A108.5°4.0°
C12O2C2C3137.4°64.9°
C12O2C2O619.0°55.1°
O2C12H12H12A120.0°120.0°
O2C12H12H12B120.0°120.0°
O2C12H12AH12B120.0°120.1°
C2C3H32H31118.8°120.2°
C2C3H32C4122.4°119.6°
C2C3H31C4122.4°119.7°
C2C3C4H467.2°63.0°
C2C3C4O4173.1°176.9°
C2C3C4C551.5°57.0°
C3C2O6C656.3°61.2°
C3C2C1O1B46.9°55.7°
C3C2C1O1A133.8°124.0°
H32C3H31C4118.8°120.2°
H32C3C4H4172.8°177.2°
H32C3C4O453.1°57.1°
H32C3C4C568.5°62.9°
H32C3C2O670.4°62.2°
H31C3C4H452.9°57.0°
H31C3C4O466.9°63.1°
H31C3C4C5171.5°177.0°
H31C3C2O6169.6°177.6°
C3C4H4O4120.0°120.1°
C3C4H4C5120.9°119.6°
C3C4O4C5123.3°119.6°
C3C4O4HO4180.0°59.9°
C3C4C5C654.6°57.0°
C3C4C5H562.4°63.0°
C3C4C5N5179.3°176.9°
C4C3C2O649.6°57.6°
H4C4O4C5118.9°120.3°
H4C4O4HO462.2°60.2°
H4C4C5C663.1°62.9°
H4C4C5H5179.8°177.2°
H4C4C5N561.5°57.0°
O4C4C5C6177.1°176.9°
O4C4C5H560.0°56.9°
O4C4C5N558.2°63.2°
HO4O4C4C556.7°179.5°
C4C5C6H5121.0°120.0°
C4C5C6N5121.0°119.9°
C4C5H5N5118.4°120.1°
C4C5N5HN534.7°95.0°
C4C5C6C7174.9°177.6°
C4C5C6O656.7°57.6°
C4C5C6H668.4°62.4°
C4C5N5C10145.3°85.0°
C6C5H5N5122.1°120.1°
C6C5N5HN587.4°24.7°
C5C6C7O6120.9°119.9°
C5C6C7H6113.8°120.0°
C5C6O6H6114.4°120.0°
C5C6O6C260.6°61.2°
C5C6C7O750.9°55.0°
C5C6C7C8172.1°175.0°
C5C6C7H768.6°65.0°
C6C5N5C1092.5°155.3°
H5C5N5HN5155.7°144.8°
H5C5C6C753.9°57.7°
H5C5C6O664.3°62.4°
H5C5C6H6170.6°177.6°
H5C5N5C1024.3°35.2°
C5N5HN5C10180.0°180.0°
N5C5C6C764.0°62.5°
N5C5C6O6177.7°177.5°
N5C5C6H652.6°57.5°
C5N5C10O103.5°0.0°
C5N5C10C11178.2°180.0°
HN5N5C10O10176.5°180.0°
HN5N5C10C111.8°0.0°
C7C6O6H6117.4°120.0°
C7C6O6C2171.2°178.8°
C6C7O7C8121.9°120.0°
C6C7O7H7118.8°120.0°
C6C7C8H7118.8°120.0°
C6C7O7HO772.3°60.0°
C6C7C8H878.6°60.0°
C6C7C8O841.7°60.0°
C6C7C8C9162.3°180.0°
O6C6C7O770.0°64.9°
O6C6C7C851.3°55.1°
O6C6C7H7170.5°175.1°
H6C6O6C253.7°58.8°
H6C6C7O7164.7°175.0°
H6C6C7C874.1°65.0°
H6C6C7H745.2°55.0°
O6C2C1O1B167.9°64.3°
O6C2C1O1A12.8°116.0°
O7C7C8H7119.5°120.0°
O7C7C8H843.1°60.0°
O7C7C8O8163.4°180.0°
O7C7C8C976.0°60.0°
C8C7O7HO7165.8°60.0°
C7C8H8O8119.7°120.0°
C7C8H8C9120.9°120.0°
C7C8O8C9122.0°120.0°
C7C8O8HO857.1°60.0°
C7C8C9O9170.8°175.0°
C7C8C9H9250.8°55.0°
C7C8C9H9169.2°65.0°
H7C7O7HO746.5°180.0°
H7C7C8H8162.6°NaN°
H7C7C8O877.1°60.0°
H7C7C8C943.6°60.0°
H8C8O8C9119.1°120.0°
H8C8O8HO861.8°180.0°
H8C8C9O951.9°55.0°
H8C8C9H9268.1°65.0°
H8C8C9H91172.0°175.0°
O8C8C9O968.4°65.0°
O8C8C9H92171.6°175.1°
O8C8C9H9151.6°55.0°
HO8O8C8C9179.1°60.0°
C8C9O9H92120.0°120.0°
C8C9O9H91120.0°120.0°
C8C9H92H91120.3°120.0°
C8C9O9HO9180.0°180.0°
O9C9H92H91120.3°120.0°
H92C9O9HO960.0°60.0°
H91C9O9HO960.0°60.0°
N5C10O10C11178.4°179.9°
N5C10C11H111117.1°60.1°
N5C10C11O112.9°180.0°
N5C10C11H113122.9°60.0°
O10C10C11H11161.3°120.0°
O10C10C11O11178.6°0.0°
O10C10C11H11358.6°119.9°
C10C11H111O11127.1°120.0°
C10C11H111H113116.4°120.0°
C10C11O11H113120.0°120.0°
C10C11O11H20180.0°180.0°
H111C11O11H113120.0°120.1°
H111C11O11H2060.0°60.0°
H12C12H12AH12B120.0°119.9°
O1AC1O1BHO1B0.0°0.3°
H113C11O11H2060.0°60.0°

221716

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