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MW7

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
O11C09doub1.21Å1.26Å
C09O10sing1.35Å1.26Å
C09C06sing1.48Å1.53Å
C07C06doub1.40Å1.39ÅAromatic
C07C08sing1.37Å1.38ÅAromatic
C06C05sing1.40Å1.38ÅAromatic
C08C03doub1.40Å1.38ÅAromatic
C01C02doub1.33Å1.32Å
C05C04doub1.37Å1.39ÅAromatic
C03C04sing1.40Å1.39ÅAromatic
C03C02sing1.48Å1.53Å
C01H1sing1.08Å1.08Å
C01H2sing1.08Å1.08Å
C02H3sing1.08Å1.08Å
C04H4sing1.08Å1.08Å
C05H5sing1.08Å1.08Å
C07H6sing1.08Å1.08Å
C08H7sing1.08Å1.08Å
O10H8sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O11C09O10120.4°120.0°
O11C09C06120.1°120.0°
O10C09C06119.5°120.0°
C09O10H8109.5°117.0°
C09C06C07120.5°120.0°
C09C06C05119.5°120.0°
C06C07C08119.8°120.0°
C07C06C05120.0°120.0°
C06C07H6120.1°120.0°
C07C08C03120.2°120.0°
C08C07H6120.1°120.0°
C07C08H7119.9°120.1°
C06C05C04120.0°120.0°
C06C05H5120.0°120.0°
C08C03C04119.9°120.0°
C08C03C02120.7°120.0°
C03C08H7119.9°119.9°
C01C02C03121.6°120.0°
C02C01H1120.0°120.0°
C02C01H2120.0°120.0°
C01C02H3119.2°120.0°
C05C04C03120.0°120.0°
C05C04H4120.0°120.0°
C04C05H5120.0°120.0°
C04C03C02119.4°120.0°
C03C04H4120.0°120.0°
C03C02H3119.2°120.0°
H1C01H2120.0°120.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O11C09O10C06179.6°180.0°
O11C09C06C0714.3°180.0°
O11C09C06C05165.3°0.0°
O11C09O10H80.0°0.0°
O10C09C06C07166.0°0.0°
O10C09C06C0514.3°180.0°
C09C06C07C05179.6°180.0°
C09C06C07C08179.6°179.8°
C09C06C05C04179.8°180.0°
C09C06C05H50.2°0.1°
C09C06C07H60.4°0.0°
C06C09O10H8179.6°180.0°
C06C07C08H6180.0°179.7°
C06C07C08C030.1°0.5°
C07C06C05C040.2°0.0°
C07C06C05H5179.8°180.0°
C06C07C08H7179.9°180.0°
C08C07C06C050.0°0.3°
C07C08C03H7180.0°179.5°
C07C08C03C040.3°0.5°
C07C08C03C02179.7°179.8°
C06C05C04H5180.0°179.9°
C06C05C04C030.5°0.0°
C06C05C04H4179.5°180.0°
C05C06C07H6180.0°180.0°
C08C03C02C0116.9°0.3°
C08C03C04C050.5°0.3°
C08C03C04C02179.3°179.7°
C08C03C02H3163.1°179.8°
C08C03C04H4179.5°179.8°
C03C08C07H6180.0°179.8°
C01C02C03C04162.4°180.0°
C01C02C03H3180.0°179.9°
C02C01H1H2180.0°179.7°
C05C04C03H4180.0°180.0°
C05C04C03C02179.9°180.0°
C04C03C02H317.6°0.1°
C03C04C05H5179.6°180.0°
C04C03C08H7179.6°180.0°
C03C02C01H10.0°180.0°
C03C02C01H2180.0°0.2°
C02C03C04H40.1°0.1°
C02C03C08H70.3°0.3°
H1C01C02H3180.0°0.0°
H2C01C02H30.0°179.7°
H4C04C05H50.4°0.1°
H6C07C08H70.1°0.2°

223166

PDB entries from 2024-07-31

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