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88181-59-3

88181-59-3 | Ruthenium(2+),tris(pyrazino[2,3-f]quinoxaline-kN1,kN10)-, dichloride, (OC-6-11)-(9CI)

CAS No: 88181-59-3 Catalog No: AG004CMF MDL No:

Product Description

Catalog Number:
AG004CMF
Chemical Name:
Ruthenium(2+),tris(pyrazino[2,3-f]quinoxaline-kN1,kN10)-, dichloride, (OC-6-11)-(9CI)
CAS Number:
88181-59-3
Molecular Formula:
C30H18N12Ru
Molecular Weight:
647.6143
IUPAC Name:
pyrazino[2,3-f]quinoxaline;ruthenium(2+);chloride
InChI:
InChI=1S/3C10H6N4.ClH.Ru/c3*1-2-8-10(14-6-4-12-8)9-7(1)11-3-5-13-9;;/h3*1-6H;1H;/q;;;;+2/p-1
InChI Key:
ZRIGPLBURIMKPF-UHFFFAOYSA-M
SMILES:
c1cnc2c(n1)c1nccnc1cc2.c1cnc2c(n1)c1nccnc1cc2.c1cnc2c(n1)c1nccnc1cc2.[Ru]

Properties

Complexity:
186  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
5  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
683.051g/mol
Formal Charge:
1  
Heavy Atom Count:
44  
Hydrogen Bond Acceptor Count:
13  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
683.078g/mol
Monoisotopic Mass:
683.051g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
155A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

Literature

Title Journal
Photocrosslinking between peptide-peptide or peptide-oligonucleotide by Ru(II)-TAP complexes. Chemistry (Weinheim an der Bergstrasse, Germany) 20120102
Density functional theory interpretation of the 1H photo-chemically induced dynamic nuclear polarization enhancements characterizing photoreduced polyazaaromatic Ru(II) coordination complexes. Inorganic chemistry 20100906
A Ru(II)-TAP complex, photoreagent for tryptophan-containing peptides: structure of the covalent photoadduct. Inorganic chemistry 20100802

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