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96380-91-5 | zinc bis(1,3-benzothiazole-2-thiolate)
CAS No: 96380-91-5 Catalog No: AG005URJ MDL No:
Product Description
Catalog Number:
AG005URJ
Chemical Name:
zinc bis(1,3-benzothiazole-2-thiolate)
CAS Number:
96380-91-5
Molecular Formula:
C14H8N2S4Zn
Molecular Weight:
397.8667
IUPAC Name:
zinc;1,3-benzothiazole-2-thiolate
InChI:
InChI=1S/2C7H5NS2.Zn/c2*9-7-8-5-3-1-2-4-6(5)10-7;/h2*1-4H,(H,8,9);/q;;+2/p-2
InChI Key:
PGNWIWKMXVDXHP-UHFFFAOYSA-L
SMILES:
[S-]c1nc2c(s1)cccc2.[S-]c1nc2c(s1)cccc2.[Zn+2]
EC Number:
205-840-3
UNII:
HMM5IX9Q3B
RTECS Number:
DL7000000
Properties
Complexity:
129
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
395.886g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
397.852g/mol
Monoisotopic Mass:
395.886g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
84.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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