Bis(2,2,6,6-tetramethyl-3,5-heptanedionato)nickel(II)
Catalog Number
ACM14481084-2
CAS
14481-08-4
IUPAC Name
Nickel(2+);(E)-2,2,6,6-tetramethyl-5-oxohept-3-en-3-olate
Synonyms
Nickel (2,2,6,6-tetramethyl-3,5-heptanedionate)
Molecular Weight
425.2
Molecular Formula
C22H40NiO4
Product Information
Canonical SMILES
CC(C)(C)C(=CC(=O)C(C)(C)C)[O-].CC(C)(C)C(=CC(=O)C(C)(C)C)[O-].[Ni+2]
InChI
InChI=1S/2C11H20O2.Ni/c2*1-10(2,3)8(12)7-9(13)11(4,5)6;/h2*7,12H,1-6H3;/q;+2/p-2/b2*8-7+;
InChI Key
PIIJAZNTPALBJL-ORWWTJHYSA-L
Melting Point
219-223 °C
Purity
95%+
Appearance
Purple crystal
Storage
Under inert gas (nitrogen or Argon) at 2-8 °C
Complexity
199
Covalently-Bonded Unit Count
3
Exact Mass
424.212351
Hazard Statements
H302-H312-H332-H350
Heavy Atom Count
27
Hydrogen Bond Acceptor Count
4
Hydrogen Bond Donor Count
2
MDL Number
MFCD00192348
Monoisotopic Mass
424.212351
Rotatable Bond Count
6
Topological Polar Surface Area
80.3 Ų
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