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Home > Pyridines > 649774-43-6
649774-43-6 | Pyridine, 4-[2-(1,3-dithiol-2-ylidene)-1,3-dithiol-4-yl]-
CAS No: 649774-43-6 Catalog No: AG00H6PI MDL No:
Product Description
Catalog Number:
AG00H6PI
Chemical Name:
Pyridine, 4-[2-(1,3-dithiol-2-ylidene)-1,3-dithiol-4-yl]-
CAS Number:
649774-43-6
Molecular Formula:
C11H7NS4
Molecular Weight:
281.4400
IUPAC Name:
4-[2-(1,3-dithiol-2-ylidene)-1,3-dithiol-4-yl]pyridine
InChI:
InChI=1S/C11H7NS4/c1-3-12-4-2-8(1)9-7-15-11(16-9)10-13-5-6-14-10/h1-7H
InChI Key:
JXKMTLHCIACKNS-UHFFFAOYSA-N
SMILES:
C1=CSC(=C2SC=C(S2)c2ccncc2)S1
Properties
Complexity:
356
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
280.946g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
281.424g/mol
Monoisotopic Mass:
280.946g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
114A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
Literature
| Title | Journal |
|---|---|
| Preparation and crystal structure of dual-functional precursor complex bis(acetylacetonato)nickel(II) with 4-pyridyltetrathiafulvalene. | Inorganic chemistry 20060821 |
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