Tris(pentane-2,4-dionato-O,O')samarium

Catalog Number	ACM14589425-1
CAS	14589-42-5
Structure
Synonyms	(Z)-4-Oxopent-2-en-2-olate;samarium(3+)
Molecular Weight	447.7
Molecular Formula	C15H21O6Sm
Canonical SMILES	CC(=CC(=O)C)[O-].CC(=CC(=O)C)[O-].CC(=CC(=O)C)[O-].[Sm+3]
InChI	InChI=1S/3C5H8O2.Sm/c3*1-4(6)3-5(2)7;/h3*3,6H,1-2H3;/q;+3/p-3/b3*4-3-;
InChI Key	YJWDTQDBHBJLOF-LNTINUHCSA-K
Melting Point	146-147 °C
Purity	99%
Appearance	Powder
Complexity	90.4
Covalently-Bonded Unit Count	4
Defined Atom Stereocenter Count	0
Exact Mass	449.05355
Heavy Atom Count	22
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	0
Isomeric SMILES	C/C(=C/C(=O)C)/[O-].C/C(=C/C(=O)C)/[O-].C/C(=C/C(=O)C)/[O-].[Sm+3]
Monoisotopic Mass	449.05355
Rotatable Bond Count	3
Topological Polar Surface Area	120 Ų