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[N-[alpha-[2-(Dibutylglycinamido)phenyl]benzylidene]glycinato]nickel

Catalog Number ACM847654164-1
CAS 847654-16-4
Structure [N-[alpha-[2-(Dibutylglycinamido)phenyl]benzylidene]glycinato]nickel
Synonyms [2-[N-(Carboxymethyl)-C-phenylcarbonimidoyl]phenyl]-[2-(dibutylamino)acetyl]azanide;nickel
Molecular Weight 481.2
Molecular Formula C25H32N3NiO3
Canonical SMILES CCCCN(CCCC)CC(=O)[N-]C1=CC=CC=C1C(=NCC(=O)O)C2=CC=CC=C2.[Ni]
InChI InChI=1S/C25H33N3O3.Ni/c1-3-5-16-28(17-6-4-2)19-23(29)27-22-15-11-10-14-21(22)25(26-18-24(30)31)20-12-8-7-9-13-20;/h7-15H,3-6,16-19H2,1-2H3,(H2,26,27,29,30,31);/p-1
InChI Key SRACNTKYERUCFU-UHFFFAOYSA-M
Purity 95%+
Exact Mass 480.179709
Hydrogen Bond Acceptor Count 6
Hydrogen Bond Donor Count 1
Monoisotopic Mass 480.179709
Rotatable Bond Count 9
Topological Polar Surface Area 71 Ų

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