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139039-84-2 | Rhenium(1+), tricarbonylchloro(4-phenylpyridine)-
CAS No: 139039-84-2 Catalog No: AG001A1W MDL No:
Product Description
Catalog Number:
AG001A1W
Chemical Name:
Rhenium(1+), tricarbonylchloro(4-phenylpyridine)-
CAS Number:
139039-84-2
Molecular Formula:
C14H6ClNO3Re+
Molecular Weight:
457.8623
IUPAC Name:
[bis(oxomethylidene)-(4-phenylpyridin-2-yl)-λ7-chloranylidene]methanone;rhenium
InChI:
InChI=1S/C14H8ClNO3.Re/c17-9-15(10-18,11-19)14-8-13(6-7-16-14)12-4-2-1-3-5-12;/h1-8H;
InChI Key:
FGQBITIAERFGKR-UHFFFAOYSA-N
SMILES:
O=C=C1C(=NC(=C=O)C(=C=O)C1c1ccccc1)Cl.[Re+]
Properties
Complexity:
516
Compound Is Canonicalized:
No
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
459.975g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
459.879g/mol
Monoisotopic Mass:
459.975g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
64.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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