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13954-65-9 | Benzenediazonium, 4,4'-thiobis-, chloride (1:2)
CAS No: 13954-65-9 Catalog No: AG001B7K MDL No:
Product Description
Catalog Number:
AG001B7K
Chemical Name:
Benzenediazonium, 4,4'-thiobis-, chloride (1:2)
CAS Number:
13954-65-9
Molecular Formula:
C12H8Cl2N4S
Molecular Weight:
311.1897
IUPAC Name:
4-(4-diazoniophenyl)sulfanylbenzenediazonium;dichloride
InChI:
InChI=1S/C12H8N4S.2ClH/c13-15-9-1-5-11(6-2-9)17-12-7-3-10(16-14)4-8-12;;/h1-8H;2*1H/q+2;;/p-2
InChI Key:
DVYLRLMPVBLKOD-UHFFFAOYSA-L
SMILES:
N#[N+]c1ccc(cc1)Sc1ccc(cc1)[N+]#N.[Cl-].[Cl-]
Properties
Complexity:
302
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
309.985g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
311.184g/mol
Monoisotopic Mass:
309.985g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
81.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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