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Details

Stereochemistry ACHIRAL
Molecular Formula 2C21H20P.2C2H3O2.2Pd
Molecular Weight 937.64
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DI(ACETATO)BIS(O-(DI-O-TOLYLPHOSPHINO)BENZYL)DIPALLADIUM, TRANS-

SMILES

[Pd++].[Pd++].CC([O-])=O.CC([O-])=O.CC1=C(C=CC=C1)P(C2=C(C)C=CC=C2)C3=C([CH2-])C=CC=C3.CC4=C(C=CC=C4)P(C5=C(C)C=CC=C5)C6=C([CH2-])C=CC=C6

InChI

InChIKey=AQTSNKXEMWZOGA-UHFFFAOYSA-L
InChI=1S/2C21H20P.2C2H4O2.2Pd/c2*1-16-10-4-7-13-19(16)22(20-14-8-5-11-17(20)2)21-15-9-6-12-18(21)3;2*1-2(3)4;;/h2*4-15H,1H2,2-3H3;2*1H3,(H,3,4);;/q2*-1;;;2*+2/p-2

HIDE SMILES / InChI

Molecular Formula Pd
Molecular Weight 106.42
Charge 2
Count
MOL RATIO 2 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C2H3O2
Molecular Weight 59.044
Charge -1
Count
MOL RATIO 2 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C21H21P
Molecular Weight 304.3652
Charge 0
Count
MOL RATIO 2 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Record UNII
0K4FY6KS4N
Record Status Validated (UNII)
Record Version