Tetrakis(acetonitrile)palladium(II) tetrafluoroborate

Catalog Number	ACM21797137-1
CAS	21797-13-7
Structure
Synonyms	Acetonitrile;palladium(2+);ditetrafluoroborate
IUPAC Name	acetonitrile;palladium(2+);ditetrafluoroborate;
Molecular Weight	444.24
Molecular Formula	C8H12B2F8N4Pd
Canonical SMILES	[B-](F)(F)(F)F.[B-](F)(F)(F)F.CC#N.CC#N.CC#N.CC#N.[Pd+2]
InChI	InChI=1S/4C2H3N.2BF4.Pd/c4*1-2-3;2*2-1(3,4)5;/h4*1H3;/q;2*-1;+2
InChI Key	YWMRPVUMBTVUEX-UHFFFAOYSA-N
Melting Point	230 °C
Purity	99%
Appearance	Grey powder
Storage	2-8°C
Complexity	48.4
Covalently-Bonded Unit Count	7
Defined Atom Stereocenter Count	0
Exact Mass	444.01551
Heavy Atom Count	23
Hydrogen Bond Acceptor Count	14
Hydrogen Bond Donor Count	0
Monoisotopic Mass	444.01551
Rotatable Bond Count	0
Topological Polar Surface Area	95.2 Ų