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Dicarbonylbis(nitrato-O)bis(triphenylphosphine)ruthenium

Catalog Number ACM60284299
CAS 60284-29-9
Synonyms Carbon monoxide;nitric acid;ruthenium;triphenylphosphanium
Molecular Weight 809.7
Molecular Formula C38H34N2O8P2Ru
Canonical SMILES [C-]#[O+].[C-]#[O+].C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.[N+](=O)(O)[O-].[N+](=O)(O)[O-].[Ru]
InChI InChI=1S/2C18H15P.2CO.2HNO3.Ru/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;2*1-2;2*2-1(3)4;/h2*1-15H;2*(H,2,3,4);/p+2
InChI Key KQNQTJLPCCPMLK-UHFFFAOYSA-P
Purity 98%
Complexity 750
Covalently-Bonded Unit Count 7
Defined Atom Stereocenter Count 0
Exact Mass 810.08338
Heavy Atom Count 51
Hydrogen Bond Acceptor Count 8
Hydrogen Bond Donor Count 2
Monoisotopic Mass 810.08338
Rotatable Bond Count 6
Topological Polar Surface Area 134 Ų

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