Carbonylhydrido[6-(di-t-butylphosphinomethylene)-2-(N,N-diethylaminomethyl)-1,6-dihydropyridine]ruthenium(II)

Catalog Number	ACM863971635-1
CAS	863971-63-5
Structure
Synonyms	Carbon monoxide;N-[[(6E)-6-(ditert-butylphosphanylmethylidene)pyridin-1-id-2-yl]methyl]-N-ethylethanamine;hydride;ruthenium(2+)
Molecular Weight	451.5
Molecular Formula	C20H35N2OPRu
Canonical SMILES	[H-].CCN(CC)CC1=CC=CC(=CP(C(C)(C)C)C(C)(C)C)[N-]1.[C-]#[O+].[Ru+2]
InChI	InChI=1S/C19H34N2P.CO.Ru.H/c1-9-21(10-2)14-16-12-11-13-17(20-16)15-22(18(3,4)5)19(6,7)8;1-2;/h11-13,15H,9-10,14H2,1-8H3;/q-1;+2;-1/b17-15+;
InChI Key	FGPPOYVQHGYDJC-VHPYDAKRSA-N
Purity	98%
Appearance	Solid
Exact Mass	452.153041
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isomeric SMILES	[H-].CCN(CC)CC1=CC=C/C(=C\P(C(C)(C)C)C(C)(C)C)/[N-]1.[C-]#[O+].[Ru+2]
Monoisotopic Mass	452.153041
Rotatable Bond Count	7
Topological Polar Surface Area	5.2 Ų