Chlorotricarbonyl(4,4'-di-t-butyl-2,2'-bipyridine)rhenium(I)

Catalog Number	ACM165612191-1
CAS	165612-19-1
Synonyms	4-Tert-butyl-2-(4-tert-butylpyridin-2-yl)pyridine;carbon monoxide;chlororhenium
Molecular Weight	574.09
Molecular Formula	C21H24ClN2O3Re
Canonical SMILES	CC(C)(C)C1=CC(=NC=C1)C2=NC=CC(=C2)C(C)(C)C.[C-]#[O+].[C-]#[O+].[C-]#[O+].Cl[Re]
InChI	InChI=1S/C18H24N2.3CO.ClH.Re/c1-17(2,3)13-7-9-19-15(11-13)16-12-14(8-10-20-16)18(4,5)6;3*1-2;/h7-12H,1-6H3;1H;/q;+1/p-1
InChI Key	NVKZHMBAFXROBZ-UHFFFAOYSA-M
Purity	99%
Appearance	Yellow solid
Complexity	422
Covalently-Bonded Unit Count	5
Defined Atom Stereocenter Count	0
Exact Mass	574.103298
Heavy Atom Count	28
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Monoisotopic Mass	574.103298
Rotatable Bond Count	2
Topological Polar Surface Area	28.8 Ų