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EVODEX.1-P6111

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[H][O:1][H:8].[O:2]([C:3]([C:4]([C:5]([C:6]([Cl:7])([H:10])[H:11])([H:12])[H:13])([H:14])[H:15])([H:16])[H:17])[H:18]>>[H][Cl:7].[O:1]([C:6]([C:5]([C:4]([C:3]([O:2][H:18])([H:16])[H:17])([H:14])[H:15])([H:12])[H:13])([H:10])[H:11])[H:8]

Derived Operators

EVODEX.1-F7 - Elemental Balance

EVODEX.1-M1 - Mass Difference

0.0

EVODEX.1-E88 - Reaction Operator E

Reaction Operator E SMIRKS

[#6:13]-[#6:14](-[#17:15])(-[H:17])-[H:18].[#8:16](-[H:46])-[H]>>[#6:13]-[#6:14](-[#8:16]-[H:46])(-[H:17])-[H:18].[#17:15]-[H]

EVODEX.1-C139 - Reaction Operator C

Reaction Operator C SMIRKS

[H]-[#8:1].[#6:6]-[#17:7]>>[H]-[#17:7].[#8:1]-[#6:6]

EVODEX.1-N901 - Reaction Operator N

Reaction Operator N SMIRKS

[H]-[#8:1]-[H:8].[#6:5]-[#6:6](-[#17:7])(-[H:10])-[H:11]>>[H]-[#17:7].[#8:1](-[#6:6](-[#6:5])(-[H:10])-[H:11])-[H:8]

EVODEX.1-Em709 - Reaction Operator Em

Reaction Operator Em SMIRKS

[H]-[#8:1].[#6:5]-[#6:6]-[#17:7]>>[H]-[#17:7].[#8:1]-[#6:6]-[#6:5]

EVODEX.1-Cm158 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[H]-[#8:1].[#6:6]-[#17:7]>>[H]-[#17:7].[#8:1]-[#6:6]

EVODEX.1-Nm638 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[H]-[#8:1].[#6:5]-[#6:6]-[#17:7]>>[H]-[#17:7].[#8:1]-[#6:6]-[#6:5]

Source Full Reactions

EVODEX.1-R6720

Full Reaction Rendering

[H][O:1][H:8].[O:2]([C:3]([C:4]([C:5]([C:6]([Cl:7])([H:10])[H:11])([H:12])[H:13])([H:14])[H:15])([H:16])[H:17])[H:18]>>[H][Cl:7].[O:1]([C:6]([C:5]([C:4]([C:3]([O:2][H:18])([H:16])[H:17])([H:14])[H:15])([H:12])[H:13])([H:10])[H:11])[H:8]