Gadolinium(III) oxalate hydrate

Catalog Number	ACM100655003-2
CAS	100655-00-3
Structure
Synonyms	Gadolinium oxalate
Molecular Weight	596.6
Molecular Formula	C6H2Gd2O13
Canonical SMILES	C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].O.[Gd+3].[Gd+3]
InChI	InChI=1S/3C2H2O4.2Gd.H2O/c3*3-1(4)2(5)6;/h3*(H,3,4)(H,5,6);1H2/q;2*+3;/p-6
InChI Key	QZPKJYRHVDRDAQ-UHFFFAOYSA-H
Melting Point	110 °C
Purity	99%+
Appearance	Powder
Complexity	60.5
Covalently-Bonded Unit Count	6
Defined Atom Stereocenter Count	0
Exact Mass	599.80071
Heavy Atom Count	21
Hydrogen Bond Acceptor Count	13
Hydrogen Bond Donor Count	1
Monoisotopic Mass	597.79776
Rotatable Bond Count	0
Topological Polar Surface Area	242 Ų