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Carbonylchlorohydrido[bis(2-di-t-butylphosphinoethyl)amine]ruthenium(II)

Catalog Number ACM1421060107-1
CAS 1421060-10-7
Synonyms Carbon monoxide;chloro(hydrido)ruthenium;2-ditert-butylphosphanyl-N-(2-ditert-butylphosphanylethyl)ethanamine
Molecular Weight 527.1
Molecular Formula C21H46ClNOP2Ru
Canonical SMILES CC(C)(C)P(CCNCCP(C(C)(C)C)C(C)(C)C)C(C)(C)C.[C-]#[O+].Cl[RuH]
InChI InChI=1S/C20H45NP2.CO.ClH.Ru.H/c1-17(2,3)22(18(4,5)6)15-13-21-14-16-23(19(7,8)9)20(10,11)12;1-2;/h21H,13-16H2,1-12H3;1H;/q;+1;/p-1
InChI Key ISDWBJDAOYEKGL-UHFFFAOYSA-M
Purity 97%
Appearance Off-white solid
Complexity 287
Covalently-Bonded Unit Count 3
Defined Atom Stereocenter Count 0
Exact Mass 527.178657
Heavy Atom Count 27
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
Monoisotopic Mass 527.178657
Rotatable Bond Count 10
Topological Polar Surface Area 13 Ų

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