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EVODEX.1-P255

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[O:1]=[O:2].[O:3]([C:4]1:[C:5]([H:18]):[C:6]([H:19]):[C:7]([H:20]):[C:8]([C:9]2:[C:10]([H:21]):[C:11]([H:22]):[C:12]([H:23]):[C:13]([H:24]):[C:14]:2[Cl:15]):[C:16]:1[O:17][H:25])[H:26]>>[O:1]=[C:8]([C:7](=[C:6]([C:5](=[C:4]([O:3][H:26])[C:16](=[O:2])[O:17][H:25])[H:18])[H:19])[H:20])[C:9]1:[C:10]([H:21]):[C:11]([H:22]):[C:12]([H:23]):[C:13]([H:24]):[C:14]:1[Cl:15]

Derived Operators

EVODEX.1-F7 - Elemental Balance

EVODEX.1-M1 - Mass Difference

0.0

EVODEX.1-E286 - Reaction Operator E

Reaction Operator E SMIRKS

[#8:1]=[#8:2].[#6:4]1:[#6:5]:[#6:7]:[#6:8]:[#6:9](-[#6:10]):[#6:16]:1-[#8:17]>>[#8:1]=[#6:9](-[#6:8]=[#6:7]-[#6:5]=[#6:4]-[#6:16](=[#8:2])-[#8:17])-[#6:10]

EVODEX.1-C74 - Reaction Operator C

Reaction Operator C SMIRKS

nan

EVODEX.1-N136 - Reaction Operator N

Reaction Operator N SMIRKS

nan

EVODEX.1-Em219 - Reaction Operator Em

Reaction Operator Em SMIRKS

[#8:1]=[#8:2].[#6:4]1:[#6:5]:[#6:6]:[#6:7]:[#6:8](-[#6:9]):[#6:17]:1-[#8:18]>>[#8:1]=[#6:8](-[#6:7]=[#6:6]-[#6:5]=[#6:4]-[#6:17](=[#8:2])-[#8:18])-[#6:9]

EVODEX.1-Cm113 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

nan

EVODEX.1-Nm218 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

nan

Source Full Reactions

EVODEX.1-R294

Full Reaction Rendering

[O:1]=[O:2].[O:3]([C:4]1:[C:5]([H:18]):[C:6]([H:19]):[C:7]([H:20]):[C:8]([C:9]2:[C:10]([H:21]):[C:11]([H:22]):[C:12]([H:23]):[C:13]([H:24]):[C:14]:2[Cl:15]):[C:16]:1[O:17][H:25])[H:26]>>[O:1]=[C:8]([C:7](=[C:6]([C:5](=[C:4]([O:3][H:26])[C:16](=[O:2])[O:17][H:25])[H:18])[H:19])[H:20])[C:9]1:[C:10]([H:21]):[C:11]([H:22]):[C:12]([H:23]):[C:13]([H:24]):[C:14]:1[Cl:15]