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A1H8R

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
O1B2sing0.00Å1.48Å
B2O3sing0.00Å1.53Å
O3C4sing0.00Å1.43Å
C4C5sing0.00Å1.54Å
C5N6sing0.00Å1.48Å
C4C7sing0.00Å1.50Å
C7C8doub0.00Å1.39ÅAromatic
C8C9sing0.00Å1.37ÅAromatic
C9C10doub0.00Å1.38ÅAromatic
C10C11sing0.00Å1.37ÅAromatic
C11C12doub0.00Å1.39ÅAromatic
C12B2sing0.00Å1.58Å
C12C7sing0.00Å1.39ÅAromatic
C11H11sing0.00Å1.08Å
C9H9sing0.00Å1.08Å
C8H8sing0.00Å1.08Å
C4H4sing0.00Å1.10Å
C10H10sing0.00Å1.08Å
C5H5Asing0.00Å1.10Å
C5H5Bsing0.00Å1.10Å
N6H6Bsing0.00Å1.00Å
N6H6Csing0.00Å1.00Å
O1H1sing0.00Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O1B2O3107.5°90.0°
O1B2C12111.1°90.0°
B2O1H1109.5°90.0°
B2O3C4112.7°90.0°
O3B2C12100.7°90.0°
O3C4C5113.7°90.0°
O3C4C7105.9°90.0°
O3C4H4107.8°90.0°
C4C5N6130.5°90.0°
C5C4C7115.4°90.0°
C5C4H4106.6°90.0°
C4C5H5A104.0°90.0°
C4C5H5B104.0°90.0°
N6C5H5A104.0°90.0°
N6C5H5B104.0°90.0°
C5N6H6B109.5°90.0°
C5N6H6C109.5°90.0°
C4C7C8127.0°90.0°
C4C7C12111.4°90.0°
C7C4H4107.0°90.0°
C7C8C9119.6°90.0°
C8C7C12121.6°90.0°
C7C8H8120.2°90.0°
C8C9C10119.6°90.0°
C8C9H9120.2°90.0°
C9C8H8120.2°90.0°
C9C10C11120.5°90.0°
C10C9H9120.2°90.0°
C9C10H10119.7°90.0°
C10C11C12121.9°90.0°
C10C11H11119.0°90.0°
C11C10H10119.8°90.0°
C11C12B2133.9°90.0°
C11C12C7116.7°90.0°
C12C11H11119.0°90.0°
B2C12C7109.3°90.0°
H5AC5H5B109.4°90.0°
H6BN6H6C109.5°90.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O1B2O3C12116.3°90.0°
O1B2O3C4116.5°90.0°
O1B2C12C1164.4°90.0°
O1B2C12C7112.1°90.0°
B2O3C4C5129.4°90.0°
B2O3C4C71.7°90.0°
O3B2C12C11178.0°90.0°
O3B2C12C71.5°90.0°
B2O3C4H4112.7°90.0°
O3B2O1H10.0°90.0°
O3C4C5C7122.7°90.0°
O3C4C5H4118.7°90.0°
O3C4C5N674.0°90.0°
O3C4C7H4114.9°90.0°
O3C4C7C8176.0°90.0°
C4O3B2C120.2°90.0°
O3C4C7C122.7°90.0°
O3C4C5H5A48.7°90.0°
O3C4C5H5B163.2°90.0°
C4C5N6H5A122.7°90.0°
C4C5N6H5B122.7°90.0°
C5C4C7H4118.4°90.0°
C5C4C7C849.3°90.0°
C5C4C7C12129.4°90.0°
C4C5H5AH5B110.7°90.0°
C4C5N6H6B180.0°90.0°
C4C5N6H6C60.0°90.0°
N6C5C4C748.6°90.0°
N6C5C4H4167.3°90.0°
N6C5H5AH5B110.6°90.0°
C5N6H6BH6C120.0°90.0°
C4C7C8C12178.6°90.0°
C4C7C8C9179.4°90.0°
C4C7C12C11179.8°90.0°
C4C7C12B22.6°90.0°
C4C7C8H80.6°90.0°
C7C4C5H5A171.3°90.0°
C7C4C5H5B74.1°90.0°
C7C8C9H8180.0°90.0°
C7C8C9C100.6°90.0°
C8C7C12C111.0°90.0°
C8C7C12B2176.2°90.0°
C7C8C9H9179.4°90.0°
C8C7C4H469.1°90.0°
C8C9C10H9180.0°90.0°
C8C9C10C110.5°90.0°
C9C8C7C120.8°90.0°
C8C9C10H10179.5°90.0°
C9C10C11H10180.0°90.0°
C9C10C11C120.7°90.0°
C9C10C11H11179.3°90.0°
C10C9C8H8179.4°90.0°
C10C11C12H11180.0°90.0°
C10C11C12B2175.4°90.0°
C10C11C12C70.9°90.0°
C11C10C9H9179.5°90.0°
C11C12B2C7176.5°90.0°
C12C11C10H10179.3°90.0°
B2C12C11H114.6°90.0°
C12B2O1H1109.2°90.0°
C7C12C11H11179.1°90.0°
C12C7C8H8179.2°90.0°
C12C7C4H4112.2°90.0°
H11C11C10H100.7°90.0°
H9C9C8H80.6°90.0°
H9C9C10H100.5°90.0°
H4C4C5H5A70.0°90.0°
H4C4C5H5B44.6°90.0°
H5AC5N6H6B57.3°90.0°
H5AC5N6H6C177.3°90.0°
H5BC5N6H6B57.3°90.0°
H5BC5N6H6C62.8°90.0°

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PDB entries from 2026-03-25

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