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82679-06-9 | 1,3-Dithiole, 2-(1,3-dithiol-2-ylidene)-4-(phenylseleno)-
CAS No: 82679-06-9 Catalog No: AG004WUO MDL No:
Product Description
Catalog Number:
AG004WUO
Chemical Name:
1,3-Dithiole, 2-(1,3-dithiol-2-ylidene)-4-(phenylseleno)-
CAS Number:
82679-06-9
Molecular Formula:
C12H8S4Se
Molecular Weight:
359.4119
IUPAC Name:
2-(1,3-dithiol-2-ylidene)-4-phenylselanyl-1,3-dithiole
InChI:
InChI=1S/C12H8S4Se/c1-2-4-9(5-3-1)17-10-8-15-12(16-10)11-13-6-7-14-11/h1-8H
InChI Key:
TXPKZQVXJMJTDK-UHFFFAOYSA-N
SMILES:
C1=CSC(=C2SC=C(S2)[Se]c2ccccc2)S1
Properties
Complexity:
370
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
359.867g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
359.407g/mol
Monoisotopic Mass:
359.867g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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