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CI2

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C1C2sing1.51Å1.52Å
C1H24sing1.09Å1.08Å
C1H25sing1.09Å1.09Å
C1H26sing1.09Å1.10Å
C2O3doub1.21Å1.19Å
C2C4sing1.51Å1.53Å
C4C5sing1.55Å1.57Å
C4C22sing1.52Å1.54Å
C4H27sing1.09Å1.08Å
C5C6sing1.55Å1.54Å
C5H28sing1.09Å1.08Å
C5H29sing1.09Å1.08Å
C6C7sing1.53Å1.54Å
C6H30sing1.09Å1.08Å
C6H31sing1.09Å1.08Å
C7C8sing1.52Å1.54Å
C7C22sing1.56Å1.54Å
C7H32sing1.09Å1.07Å
C8C9sing1.53Å1.57Å
C8C19sing1.54Å1.57Å
C8H33sing1.09Å1.08Å
C9C10sing1.53Å1.55Å
C9H34sing1.09Å1.08Å
C9H35sing1.09Å1.08Å
C10C11sing1.53Å1.55Å
C10H36sing1.09Å1.08Å
C10H37sing1.09Å1.08Å
C11C12sing1.53Å1.56Å
C11C17sing1.53Å1.56Å
C11H38sing1.09Å1.08Å
C12C13sing1.51Å1.55Å
C12H39sing1.09Å1.08Å
C12H40sing1.09Å1.08Å
C13O14doub1.21Å1.20Å
C13C15sing1.51Å1.54Å
C15C16sing1.53Å1.54Å
C15H41sing1.09Å1.08Å
C15H42sing1.09Å1.08Å
C16C17sing1.53Å1.56Å
C16H43sing1.09Å1.08Å
C16H44sing1.09Å1.08Å
C17C18sing1.53Å1.54Å
C17C19sing1.54Å1.58Å
C18H45sing1.09Å1.08Å
C18H46sing1.09Å1.08Å
C18H47sing1.09Å1.08Å
C19C20sing1.53Å1.56Å
C19H48sing1.09Å1.08Å
C20C21sing1.54Å1.55Å
C20H49sing1.09Å1.08Å
C20H50sing1.09Å1.08Å
C21C22sing1.52Å1.54Å
C21H51sing1.09Å1.08Å
C21H52sing1.09Å1.08Å
C22C23sing1.53Å1.53Å
C23H53sing1.09Å1.07Å
C23H54sing1.09Å1.08Å
C23H55sing1.09Å1.07Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C2C1H24108.1°109.5°
C2C1H25109.3°109.5°
C2C1H26109.5°109.4°
C1C2O3122.3°120.0°
C1C2C4116.3°120.0°
H24C1H25106.6°109.5°
H24C1H26110.2°109.5°
H25C1H26113.0°109.4°
O3C2C4121.3°120.0°
C2C4C5113.7°110.3°
C2C4C22113.6°110.2°
C2C4H27107.6°110.2°
C5C4C22106.1°105.5°
C5C4H27106.7°110.3°
C4C5C6105.5°106.4°
C4C5H28111.4°110.1°
C4C5H29111.8°110.0°
C22C4H27108.8°110.2°
C4C22C797.0°103.2°
C4C22C21115.7°117.9°
C4C22C23110.7°109.8°
C6C5H28109.6°110.1°
C6C5H29111.9°110.1°
C5C6C7102.7°103.0°
C5C6H30111.7°110.7°
C5C6H31111.0°110.8°
H28C5H29106.8°110.1°
C7C6H30111.9°110.7°
C7C6H31110.2°110.8°
C6C7C8121.1°115.9°
C6C7C22107.1°101.7°
C6C7H32102.9°110.4°
H30C6H31109.2°110.8°
C8C7C22115.0°107.7°
C8C7H32103.8°110.4°
C7C8C9110.8°110.5°
C7C8C19109.5°107.3°
C7C8H33108.1°109.7°
C22C7H32105.0°110.4°
C7C22C21109.7°108.1°
C7C22C23115.5°107.4°
C9C8C19110.8°109.9°
C9C8H33110.3°109.7°
C8C9C10112.0°109.5°
C8C9H34109.5°109.5°
C8C9H35110.3°109.5°
C19C8H33107.2°109.7°
C8C19C17113.2°108.9°
C8C19C20111.5°112.0°
C8C19H48104.7°108.0°
C10C9H34109.8°109.5°
C10C9H35109.9°109.5°
C9C10C11112.5°109.3°
C9C10H36109.5°109.5°
C9C10H37110.0°109.5°
H34C9H35105.0°109.4°
C11C10H36107.8°109.5°
C11C10H37110.8°109.5°
C10C11C12108.3°108.9°
C10C11C17112.9°109.2°
C10C11H38107.0°109.7°
H36C10H37106.0°109.5°
C12C11C17115.1°109.9°
C12C11H38107.3°109.6°
C11C12C13115.9°108.7°
C11C12H39108.2°109.6°
C11C12H40111.2°109.7°
C17C11H38105.7°109.6°
C11C17C16108.8°110.2°
C11C17C18106.2°110.0°
C11C17C19111.7°109.4°
C13C12H39106.3°109.6°
C13C12H40109.1°109.6°
C12C13O14120.3°120.9°
C12C13C15117.6°118.3°
H39C12H40105.4°109.7°
O14C13C15121.8°120.9°
C13C15C16113.6°108.4°
C13C15H41108.9°109.7°
C13C15H42107.6°109.7°
C16C15H41110.0°109.6°
C16C15H42109.4°109.6°
C15C16C17116.1°110.1°
C15C16H43110.0°109.4°
C15C16H44107.3°109.4°
H41C15H42107.1°109.8°
C17C16H43110.0°109.5°
C17C16H44107.5°109.0°
C16C17C18107.8°109.3°
C16C17C19112.8°109.3°
H43C16H44105.4°109.4°
C18C17C19109.3°108.5°
C17C18H45110.7°109.4°
C17C18H46111.3°109.5°
C17C18H47112.1°109.4°
C17C19C20116.0°110.1°
C17C19H48105.7°109.0°
H45C18H46108.8°109.4°
H45C18H47106.6°109.5°
H46C18H47107.2°109.6°
C20C19H48104.5°108.9°
C19C20C21112.5°111.4°
C19C20H49109.7°109.1°
C19C20H50110.0°109.1°
C21C20H49107.7°109.1°
C21C20H50109.6°109.1°
C20C21C22112.4°108.4°
C20C21H51108.6°109.8°
C20C21H52108.8°109.8°
H49C20H50107.2°109.1°
C22C21H51109.8°108.1°
C22C21H52110.4°110.7°
C21C22C23108.1°109.7°
H51C21H52106.6°109.9°
C22C23H53110.6°109.5°
C22C23H54111.9°109.5°
C22C23H55110.8°109.4°
H53C23H54107.9°109.5°
H53C23H55108.0°109.6°
H54C23H55107.5°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C2C1H24H25117.4°120.1°
C2C1H24H26119.7°119.9°
C2C1H25H26122.2°119.9°
C1C2O3C4176.8°179.9°
C1C2C4C5155.4°153.9°
C1C2C4C2283.1°90.0°
C1C2C4H2737.4°31.9°
H24C1H25H26121.2°120.0°
H24C1C2O31.1°0.1°
H24C1C2C4175.8°180.0°
H25C1C2O3114.5°120.0°
H25C1C2C468.6°59.9°
H26C1C2O3121.3°120.1°
H26C1C2C455.7°60.1°
O3C2C4C521.6°26.0°
O3C2C4C2299.9°90.1°
O3C2C4H27139.6°148.0°
C2C4C5C22125.6°119.0°
C2C4C5H27118.5°122.0°
C2C4C22H27119.8°121.9°
C2C4C5C6147.9°122.4°
C2C4C5H2829.1°118.4°
C2C4C5H2990.3°3.2°
C2C4C22C7166.3°148.2°
C2C4C22C2177.8°92.8°
C2C4C22C2345.6°33.9°
C5C4C22H27114.5°119.0°
C4C5C6H28120.0°119.3°
C4C5C6H29121.7°119.2°
C4C5H28H29122.3°121.5°
C4C5C6C76.5°24.0°
C4C5C6H30126.6°142.3°
C4C5C6H31111.3°94.4°
C5C4C22C740.7°29.1°
C5C4C22C21156.5°148.1°
C5C4C22C2380.0°85.2°
C22C4C5C622.3°3.4°
C22C4C5H2896.5°122.6°
C22C4C5H29144.1°115.8°
C4C22C7C646.2°44.2°
C4C22C7C8176.2°166.5°
C4C22C7C21120.5°125.6°
C4C22C7C23117.0°116.1°
C4C22C7H3262.8°73.0°
C4C22C21C20161.8°178.5°
C4C22C21C23124.9°126.7°
C4C22C21H5140.8°59.5°
C4C22C21H5276.4°61.0°
C4C22C23H53173.9°174.9°
C4C22C23H5465.8°54.9°
C4C22C23H5554.2°65.0°
H27C4C5C693.6°115.6°
H27C4C5H28147.6°3.6°
H27C4C5H2928.1°125.2°
H27C4C22C773.8°89.9°
H27C4C22C2142.0°29.1°
H27C4C22C23165.4°155.8°
C6C5H28H29121.4°121.5°
C5C6C7H30120.0°118.3°
C5C6C7H31118.3°118.4°
C5C6H30H31123.2°123.3°
C5C6C7C8168.3°158.0°
C5C6C7C2233.7°41.6°
C5C6C7H3276.7°75.6°
H28C5C6C7126.5°95.2°
H28C5C6H30113.4°23.1°
H28C5C6H318.7°146.3°
H29C5C6C7115.3°143.2°
H29C5C6H304.9°98.5°
H29C5C6H31127.0°24.8°
C7C6H30H31122.3°123.2°
C6C7C8C22131.3°113.0°
C6C7C8H32114.6°126.5°
C6C7C22H32109.0°117.2°
C6C7C8C951.3°63.2°
C6C7C8C19173.7°177.0°
C6C7C8H3369.7°57.9°
C6C7C22C21166.7°169.9°
C6C7C22C2370.8°71.8°
H30C6C7C871.7°83.7°
H30C6C7C22153.7°159.9°
H30C6C7H3243.3°42.7°
H31C6C7C850.0°39.5°
H31C6C7C2284.6°76.9°
H31C6C7H32165.0°165.9°
C8C7C22H32113.4°120.6°
C7C8C9C19121.8°118.2°
C7C8C9H33119.7°121.1°
C7C8C19H33117.1°119.1°
C7C8C9C10176.0°178.0°
C7C8C9H3461.8°58.0°
C7C8C9H3553.2°61.9°
C7C8C19C17175.0°179.7°
C7C8C19C2052.0°58.4°
C7C8C19H4860.3°61.5°
C8C7C22C2155.6°67.9°
C8C7C22C2366.8°50.4°
C22C7C8C9177.5°176.2°
C22C7C8C1955.0°64.0°
C22C7C8H3361.5°55.1°
C7C22C21C2053.5°62.0°
C7C22C21C23126.8°116.8°
C7C22C21H5167.5°56.9°
C7C22C21H52175.2°177.4°
C7C22C23H5365.0°63.3°
C7C22C23H54174.7°56.6°
C7C22C23H5554.8°176.6°
H32C7C8C963.4°63.3°
H32C7C8C1959.1°56.5°
H32C7C8H33175.6°175.6°
H32C7C22C2157.8°52.7°
H32C7C22C23179.8°171.0°
C9C8C19H33120.5°120.7°
C8C9C10H34121.9°120.0°
C8C9C10H35123.0°120.0°
C8C9H34H35118.4°120.0°
C8C9C10C1155.1°60.2°
C8C9C10H3664.8°179.8°
C8C9C10H37179.0°59.7°
C9C8C19C1752.5°59.5°
C9C8C19C20174.5°178.6°
C9C8C19H4862.1°58.7°
C19C8C9C1054.3°59.8°
C19C8C9H34176.4°60.2°
C19C8C9H3568.6°179.8°
C8C19C17C1150.6°60.1°
C8C19C17C16173.5°179.1°
C8C19C17C1866.6°60.0°
C8C19C17C20130.7°123.1°
C8C19C17H48114.0°117.6°
C8C19C20H48112.5°119.4°
C8C19C20C2153.0°54.7°
C8C19C20H49172.8°175.1°
C8C19C20H5069.6°65.8°
H33C8C9C1064.3°60.9°
H33C8C9H3457.8°179.1°
H33C8C9H35172.8°59.1°
H33C8C19C1767.9°61.2°
H33C8C19C2065.1°60.7°
H33C8C19H48177.4°179.4°
C10C9H34H35118.2°120.0°
C9C10C11H36120.9°120.0°
C9C10C11H37123.6°119.9°
C9C10H36H37118.6°120.0°
C9C10C11C1275.7°59.1°
C9C10C11C1753.0°60.8°
C9C10C11H38168.9°179.1°
H34C9C10C11177.0°59.8°
H34C9C10H3657.1°60.2°
H34C9C10H3759.0°179.8°
H35C9C10C1168.0°179.8°
H35C9C10H36172.2°59.8°
H35C9C10H3756.0°60.3°
C11C10H36H37118.7°120.1°
C10C11C12C17127.4°119.5°
C10C11C12H38115.2°120.0°
C10C11C17H38116.7°120.1°
C10C11C12C13168.0°173.5°
C10C11C12H3948.8°53.8°
C10C11C12H4066.6°66.7°
C10C11C17C16175.5°178.7°
C10C11C17C1868.8°58.1°
C10C11C17C1950.3°61.0°
H36C10C11C12163.4°60.9°
H36C10C11C1767.8°179.2°
H36C10C11H3848.0°59.1°
H37C10C11C1247.9°179.0°
H37C10C11C17176.6°59.1°
H37C10C11H3867.5°61.0°
C12C11C17H38118.2°120.5°
C11C12C13H39120.3°119.8°
C11C12C13H40126.5°119.8°
C11C12H39H40119.1°120.5°
C11C12C13O14154.1°128.3°
C11C12C13C1532.0°51.7°
C12C11C17C1650.4°61.9°
C12C11C17C18166.1°177.5°
C12C11C17C1974.8°58.4°
C17C11C12C1340.6°54.0°
C17C11C12H3978.7°65.7°
C17C11C12H40166.0°173.7°
C11C17C16C1555.0°62.2°
C11C17C16C18114.8°121.0°
C11C17C16C19124.5°120.4°
C11C17C16H43179.3°177.5°
C11C17C16H4465.1°57.8°
C11C17C18C19120.6°119.7°
C11C17C18H4556.0°61.1°
C11C17C18H46177.1°58.8°
C11C17C18H4762.8°178.9°
C11C17C19C20178.6°176.8°
C11C17C19H4863.4°57.5°
H38C11C12C1376.7°66.5°
H38C11C12H39164.0°173.8°
H38C11C12H4048.6°53.2°
H38C11C17C1667.9°58.6°
H38C11C17C1847.9°62.0°
H38C11C17C19167.0°178.9°
C13C12H39H40115.8°120.3°
C12C13O14C15173.6°180.0°
C12C13C15C1634.9°51.7°
C12C13C15H41157.8°68.0°
C12C13C15H4286.4°171.3°
H39C12C13O1485.6°111.9°
H39C12C13C1588.2°68.1°
H40C12C13O1427.6°8.5°
H40C12C13C15158.5°171.5°
O14C13C15C16151.4°128.4°
O14C13C15H4128.4°112.0°
O14C13C15H4287.4°8.7°
C13C15C16H41122.3°119.7°
C13C15C16H42120.2°119.7°
C13C15H41H42116.1°120.6°
C13C15C16C1747.8°54.2°
C13C15C16H43173.5°174.6°
C13C15C16H4472.4°65.5°
C16C15H41H42118.9°120.5°
C15C16C17H43125.6°120.4°
C15C16C17H44120.1°120.0°
C15C16H43H44115.4°119.9°
C15C16C17C18169.8°176.8°
C15C16C17C1969.5°58.2°
H41C15C16C17170.2°65.5°
H41C15C16H4364.2°54.9°
H41C15C16H4450.0°174.8°
H42C15C16C1772.4°173.9°
H42C15C16H4353.2°65.7°
H42C15C16H44167.4°54.2°
C17C16H43H44115.5°119.3°
C16C17C18C19123.0°119.2°
C16C17C18H4560.5°60.0°
C16C17C18H4660.6°180.0°
C16C17C18H47179.3°60.0°
C16C17C19C2055.7°56.0°
C16C17C19H4859.5°63.4°
H43C16C17C1864.6°56.5°
H43C16C17C1956.2°62.2°
H44C16C17C1849.7°63.2°
H44C16C17C19170.4°178.2°
C17C18H45H46122.6°119.9°
C17C18H45H47122.1°120.0°
C17C18H46H47122.9°120.0°
C18C17C19C2064.1°63.1°
C18C17C19H48179.4°177.5°
C19C17C18H45176.5°179.2°
C19C17C18H4662.3°60.9°
C19C17C18H4757.7°59.2°
C17C19C20H48116.0°119.4°
C17C19C20C21175.4°175.9°
C17C19C20H4955.7°63.6°
C17C19C20H5062.0°55.5°
H45C18H46H47114.9°120.1°
C19C20C21H49120.9°120.5°
C19C20C21H50122.8°120.4°
C19C20H49H50119.4°119.1°
C19C20C21C2254.1°55.8°
C19C20C21H5167.6°62.1°
C19C20C21H52176.6°176.9°
H48C19C20C2159.5°64.7°
H48C19C20H4960.3°55.8°
H48C19C20H50177.9°174.9°
C21C20H49H50117.9°119.1°
C20C21C22H51121.0°119.0°
C20C21C22H52121.7°120.5°
C20C21H51H52117.1°121.0°
C20C21C22C2373.3°54.8°
H49C20C21C22175.0°176.3°
H49C20C21H5153.3°58.4°
H49C20C21H5262.4°62.6°
H50C20C21C2268.7°64.6°
H50C20C21H51169.6°177.5°
H50C20C21H5253.9°56.5°
C22C21H51H52119.6°121.0°
C21C22C23H5358.3°53.9°
C21C22C23H5462.0°173.9°
C21C22C23H55178.1°66.2°
H51C21C22C23165.7°173.8°
H52C21C22C2348.4°65.7°
C22C23H53H54122.7°120.0°
C22C23H53H55121.4°120.0°
C22C23H54H55121.9°119.9°
H53C23H54H55116.3°120.1°

227344

PDB entries from 2024-11-13

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